CCOC(=O)N1CCC2=C(C1)C3=C(N2)C=CC(=C3)C
CAS: 63277-58-7
Name: ethyl 8-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carboxylate
SMILES: CCOC(=O)N1CCC2=C(C1)C3=C(N2)C=CC(=C3)C

Molecular Processing

Molecular formula
C15H18N2O2
Molecular weight
258.32
Exact mass
258.1368
XLogP
2.99
TPSA
45.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
74.17

Supplementary Information

InChIKey: HSVKCHIAGOIUCK-UHFFFAOYSA-N
Synonyms
ethyl 8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate63277-58-7ethyl 8-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carboxylateMLS000674952SMR000291993ST077036Opera_ID_1997Oprea1_239541Oprea1_670424SCHEMBL407460CHEMBL1586606DTXSID601331634HMS2715A23STK403459AKOS003293537CS-0326772UNM000011057201SR-01000506045SR-01000506045-1ethyl 8-methyl-1,2,3,4-tetrahydropyridino[4,3-b]indole-2-carboxylateEthyl 8-Methyl-3, 4-dihydro-1H-pyrido[4,3-b]indole-2(5H)-carboxylateEthyl 8-Methyl-3,4-dihydro-1H-pyrido[4,3-b]indole-2(5H)-carboxylateethyl8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate8-Methyl-1,3,4,5-tetrahydro-pyrido[4,3-b]indole-2-carboxylic acid ethyl ester
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