2-(1-amino-3-methylcyclohexyl)acetamide

C9H18N2O — CID 165483573

IUPAC2-(1-amino-3-methylcyclohexyl)acetamide
SMILESCC1CCCC(N)(CC(N)=O)C1
InChIInChI=1S/C9H18N2O/c1-7-3-2-4-9(11,5-7)6-8(10)12/h7H,2-6,11H2,1H3,(H2,10,12)
InChIKeyQNPBIPKBJTZGFT-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.77
Rot. Bonds2

About 2-(1-amino-3-methylcyclohexyl)acetamide

2-(1-amino-3-methylcyclohexyl)acetamide (PubChem CID 165483573) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-(1-amino-3-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(1-amino-3-methylcyclohexyl)acetamide
PubChem CID165483573
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-(1-amino-3-methylcyclohexyl)acetamide
SMILESCC1CCCC(N)(CC(N)=O)C1
InChIInChI=1S/C9H18N2O/c1-7-3-2-4-9(11,5-7)6-8(10)12/h7H,2-6,11H2,1H3,(H2,10,12)
InChIKeyQNPBIPKBJTZGFT-UHFFFAOYSA-N
XLogP0.77
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(1-amino-3-methylcyclohexyl)acetamide 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

methyl 2-(1-amino-3-methylcyclohexyl)acetate
CID 79848601
1-ethyl-3-methylcyclohexan-1-amine
CID 43809340
cis-(1S,3S)-1-amino-3-methylcyclohexane-1-carboxamide
CID 93311266
2-[3-methyl-1-(propylamino)cyclohexyl]acetamide
CID 65236102
3-methyl-1-(methylaminomethyl)cyclohexan-1-amine
CID 64552990
3-methyl-1-(2-methylsulfonylethyl)cyclohexan-1-amine
CID 62594696
1-[[2-(1-aminocyclobutyl)acetyl]amino]-3-methylcyclohexane-1-carboxylic acid
CID 79853770
1,3-dimethylcyclohexane-1-carboxamide
CID 71434485
1-(1-amino-3-methylcyclohexyl)-2-cyclopropylethanone
CID 116579394
(1-hydroxy-3-methylcyclohexyl)methylurea
CID 63374230
1-amino-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 64549188
1-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-3-methylcyclohexan-1-amine
CID 64554463

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-3-methylcyclohexyl)acetamide?
The IUPAC name of 2-(1-amino-3-methylcyclohexyl)acetamide (CID 165483573) is 2-(1-amino-3-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(1-amino-3-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(1-amino-3-methylcyclohexyl)acetamide is CC1CCCC(N)(CC(N)=O)C1.
What is the InChIKey of 2-(1-amino-3-methylcyclohexyl)acetamide?
The InChIKey is QNPBIPKBJTZGFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7-3-2-4-9(11,5-7)6-8(10)12/h7H,2-6,11H2,1H3,(H2,10,12).
What are the key properties of 2-(1-amino-3-methylcyclohexyl)acetamide?
2-(1-amino-3-methylcyclohexyl)acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-3-methylcyclohexyl)acetamide is sourced from PubChem (CID 165483573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).