(1S)-1-(1-methylcyclohexyl)ethanamine

C9H19N — CID 130639601

IUPAC(1S)-1-(1-methylcyclohexyl)ethanamine
SMILESC[C@H](N)C1(C)CCCCC1
InChIInChI=1S/C9H19N/c1-8(10)9(2)6-4-3-5-7-9/h8H,3-7,10H2,1-2H3/t8-/m0/s1
InChIKeyVZQYSLQGEVNWHD-QMMMGPOBSA-N
MW141.26 g/mol
LogP2.30
Rot. Bonds1

About (1S)-1-(1-methylcyclohexyl)ethanamine

(1S)-1-(1-methylcyclohexyl)ethanamine (PubChem CID 130639601) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (1S)-1-(1-methylcyclohexyl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(1-methylcyclohexyl)ethanamine
PubChem CID130639601
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(1S)-1-(1-methylcyclohexyl)ethanamine
SMILESC[C@H](N)C1(C)CCCCC1
InChIInChI=1S/C9H19N/c1-8(10)9(2)6-4-3-5-7-9/h8H,3-7,10H2,1-2H3/t8-/m0/s1
InChIKeyVZQYSLQGEVNWHD-QMMMGPOBSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1S)-1-(1-methylcyclohexyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-methyl-1-propan-2-ylazepan-3-yl)ethanamine
CID 130215546
1-[(1S)-1-aminoethyl]cyclohexan-1-ol
CID 92975390
1-(1-methylcyclopentyl)propan-1-amine
CID 114979259
2-methyl-1-(1-methylcyclopentyl)pentan-1-amine
CID 107893998
(2S)-2-amino-2-(1-methylcyclopentyl)acetaldehyde
CID 90058133
1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
CID 79081577
1-(1-methylcyclohexyl)but-3-yn-1-amine
CID 106829766
methyl 2-amino-2-(1-methylcycloheptyl)acetate
CID 130949608
1-[(1R)-1-aminoethyl]cyclohexane-1-carbonitrile
CID 90188552
1-(1-methylcyclopentyl)ethylcyclohexane
CID 91321449
N-[(1R)-1-(1-methylcyclohexyl)ethyl]sulfanylmethanamine
CID 167240637
[cycloheptyl-(1-methylcyclopentyl)methyl]hydrazine
CID 105330630

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(1-methylcyclohexyl)ethanamine?
The IUPAC name of (1S)-1-(1-methylcyclohexyl)ethanamine (CID 130639601) is (1S)-1-(1-methylcyclohexyl)ethanamine.
What is the SMILES notation for (1S)-1-(1-methylcyclohexyl)ethanamine?
The canonical SMILES for (1S)-1-(1-methylcyclohexyl)ethanamine is C[C@H](N)C1(C)CCCCC1.
What is the InChIKey of (1S)-1-(1-methylcyclohexyl)ethanamine?
The InChIKey is VZQYSLQGEVNWHD-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H19N/c1-8(10)9(2)6-4-3-5-7-9/h8H,3-7,10H2,1-2H3/t8-/m0/s1.
What are the key properties of (1S)-1-(1-methylcyclohexyl)ethanamine?
(1S)-1-(1-methylcyclohexyl)ethanamine has a molecular weight of 141.26 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(1-methylcyclohexyl)ethanamine is sourced from PubChem (CID 130639601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).