N-(3-methylidenecyclohexyl)acetamide

C9H15NO — CID 90736034

IUPACN-(3-methylidenecyclohexyl)acetamide
SMILESC=C1CCCC(NC(C)=O)C1
InChIInChI=1S/C9H15NO/c1-7-4-3-5-9(6-7)10-8(2)11/h9H,1,3-6H2,2H3,(H,10,11)
InChIKeyAFWXWRSBIQGJLI-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.62
Rot. Bonds1

About N-(3-methylidenecyclohexyl)acetamide

N-(3-methylidenecyclohexyl)acetamide (PubChem CID 90736034) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-(3-methylidenecyclohexyl)acetamide.

Molecular Properties

Compound NameN-(3-methylidenecyclohexyl)acetamide
PubChem CID90736034
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-(3-methylidenecyclohexyl)acetamide
SMILESC=C1CCCC(NC(C)=O)C1
InChIInChI=1S/C9H15NO/c1-7-4-3-5-9(6-7)10-8(2)11/h9H,1,3-6H2,2H3,(H,10,11)
InChIKeyAFWXWRSBIQGJLI-UHFFFAOYSA-N
XLogP1.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-(3-methylidenecyclohexyl)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

N-Cyclohexylmethacrylamide
CID 76215
2,2,2-trifluoro-N-(4-methylidenecyclohexyl)acetamide
CID 58902792
N-(3-fluoro-5-methylidenecyclohexyl)acetamide
CID 90885330
N-cyclohexyl-3-butenamide
CID 10487283
N-(5-cyclohexylidenepentyl)acetamide
CID 154717790
2,2,2-trifluoro-N-(4-fluoro-3-methylidenecyclohexyl)acetamide
CID 162562167
N-octa-1,7-dien-3-ylacetamide
CID 11298173
N-(6-methylhept-6-en-2-yl)acetamide
CID 19865089
N-(4-methyl-5-oxopent-4-en-2-yl)acetamide
CID 23573369
N,N-dimethyl-2-[(4-methylidenecyclohexyl)amino]acetamide
CID 58902682
N-(4-methylidenecyclohexyl)acetamide
CID 58902716
N-(4-methylidenecyclohexyl)cyclopropanecarboxamide
CID 58902731

Frequently Asked Questions

What is the IUPAC name of N-(3-methylidenecyclohexyl)acetamide?
The IUPAC name of N-(3-methylidenecyclohexyl)acetamide (CID 90736034) is N-(3-methylidenecyclohexyl)acetamide.
What is the SMILES notation for N-(3-methylidenecyclohexyl)acetamide?
The canonical SMILES for N-(3-methylidenecyclohexyl)acetamide is C=C1CCCC(NC(C)=O)C1.
What is the InChIKey of N-(3-methylidenecyclohexyl)acetamide?
The InChIKey is AFWXWRSBIQGJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-7-4-3-5-9(6-7)10-8(2)11/h9H,1,3-6H2,2H3,(H,10,11).
What are the key properties of N-(3-methylidenecyclohexyl)acetamide?
N-(3-methylidenecyclohexyl)acetamide has a molecular weight of 153.22 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylidenecyclohexyl)acetamide is sourced from PubChem (CID 90736034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).