CC(C)N(C)C1CCC(C2=C1C=CC(=C2)C#C)(C)C
Name: 6-ethynyl-N,4,4-trimethyl-N-propan-2-yl-2,3-dihydro-1H-naphthalen-1-amine
SMILES: CC(C)N(C)C1CCC(C2=C1C=CC(=C2)C#C)(C)C

Molecular Processing

Molecular formula
C18H25N
Molecular weight
255.41
Exact mass
255.1987
XLogP
4.12
TPSA
3.24
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
82.28

Supplementary Information

InChIKey: MFJYBRBHKROOPH-UHFFFAOYSA-N
Synonyme
SCHEMBL5736723MFJYBRBHKROOPH-UHFFFAOYSA-N6-ethynyl-1-(iso-propyl-methyl-amino)-4,4-dimethyl-1,2,3,4,-tetrahydro-naphthalene6-Ethynyl-1-(iso-propyl-methyl-amino)-4,4-dimethyl-1,2,3,4-tetrahydro-naphthalene6-Ethynyl-1-(iso-propyl-methyl-amino)-4,4-dimethyl-1,2,3,4-tetrahydronaphthalene
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