CCC1=C(CC)CC2=C(C1)CC(N)C2
SMILES: CCC1=C(CC)CC2=C(C1)CC(N)C2

Molecular Processing

Molecular formula
C13H21N
Molecular weight
191.32
Exact mass
191.1674
XLogP
3.31
TPSA
26.02
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
61.08

Supplementary Information

詳細情報を取得中…

1 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→