2-methyl-N-(2-methylcyclohexyl)prop-2-enamide

C11H19NO — CID 19989413

IUPAC2-methyl-N-(2-methylcyclohexyl)prop-2-enamide
SMILESC=C(C)C(=O)NC1CCCCC1C
InChIInChI=1S/C11H19NO/c1-8(2)11(13)12-10-7-5-4-6-9(10)3/h9-10H,1,4-7H2,2-3H3,(H,12,13)
InChIKeyZHSTWAYJSZUXDS-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.26
Rot. Bonds2

About 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide

2-methyl-N-(2-methylcyclohexyl)prop-2-enamide (PubChem CID 19989413) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide.

Molecular Properties

Compound Name2-methyl-N-(2-methylcyclohexyl)prop-2-enamide
PubChem CID19989413
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name2-methyl-N-(2-methylcyclohexyl)prop-2-enamide
SMILESC=C(C)C(=O)NC1CCCCC1C
InChIInChI=1S/C11H19NO/c1-8(2)11(13)12-10-7-5-4-6-9(10)3/h9-10H,1,4-7H2,2-3H3,(H,12,13)
InChIKeyZHSTWAYJSZUXDS-UHFFFAOYSA-N
XLogP2.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide 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
N-(cyclohexylmethyl)prop-2-enamide
CID 14872606
N-Cyclododecyl-2-methyl-2-propenamide
CID 66733963
N-(4-Aminocyclohexyl)-2-methylprop-2-enamide
CID 130002701
2-methyl-N-[4-(trifluoromethyl)cyclohexyl]prop-2-enamide
CID 118894918
(2E,4E)-6-chloro-4-fluoro-2-methyl-N-(2-methylcyclohexyl)hepta-2,4,6-trienamide
CID 159748355
2-Propenamide, N-(1-cyclohexylethyl)-
CID 541857
N-[(1R,2R)-2-prop-2-enylcyclohexyl]prop-2-enamide
CID 135045191
N-[1-(4-Fluorocyclohexyl)ethyl]prop-2-enamide
CID 132396322
Cyclohexanecarboxamide, N-methallyl-
CID 91695804
N-(2-ethylhexyl)-2-methylprop-2-enamide
CID 10465318
N-(1-cyclohexylethyl)-2-methylprop-2-enamide
CID 13670236

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide?
The IUPAC name of 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide (CID 19989413) is 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide.
What is the SMILES notation for 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide?
The canonical SMILES for 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide is C=C(C)C(=O)NC1CCCCC1C.
What is the InChIKey of 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide?
The InChIKey is ZHSTWAYJSZUXDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8(2)11(13)12-10-7-5-4-6-9(10)3/h9-10H,1,4-7H2,2-3H3,(H,12,13).
What are the key properties of 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide?
2-methyl-N-(2-methylcyclohexyl)prop-2-enamide has a molecular weight of 181.28 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylcyclohexyl)prop-2-enamide is sourced from PubChem (CID 19989413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).