2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide

C11H20N2O — CID 130645619

IUPAC2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide
SMILESC=CCNC(=O)C1(C)CCCCC1N
InChIInChI=1S/C11H20N2O/c1-3-8-13-10(14)11(2)7-5-4-6-9(11)12/h3,9H,1,4-8,12H2,2H3,(H,13,14)
InChIKeySAVNVIVWJFKKDL-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.20
Rot. Bonds3

About 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide

2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide (PubChem CID 130645619) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide
PubChem CID130645619
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide
SMILESC=CCNC(=O)C1(C)CCCCC1N
InChIInChI=1S/C11H20N2O/c1-3-8-13-10(14)11(2)7-5-4-6-9(11)12/h3,9H,1,4-8,12H2,2H3,(H,13,14)
InChIKeySAVNVIVWJFKKDL-UHFFFAOYSA-N
XLogP1.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide 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

2-amino-N-(cyanomethyl)-1-methylcyclopentane-1-carboxamide
CID 82767784
2-amino-1-methyl-N-[2-(methylamino)-2-oxoethyl]cyclopentane-1-carboxamide
CID 82766043
2-amino-N-(4-aminobutyl)-1-methylcyclopentane-1-carboxamide
CID 82767781
(2S)-2-amino-1-methylcyclohexane-1-carboxylic acid
CID 67285208
2-amino-N-(2,3-dihydroxypropyl)-1-methylcyclopentane-1-carboxamide
CID 82768544
2-amino-N-[(1,1-dioxothiolan-2-yl)methyl]-1-methylcyclopentane-1-carboxamide
CID 82768186
2-amino-N-(4-cyanobutyl)-1-methylcyclopentane-1-carboxamide
CID 82768534
2-amino-N-(2,2-dimethylcyclohexyl)-1-methylcyclopentane-1-carboxamide
CID 82768367
2-amino-N-(2-ethoxyethyl)-1-methylcyclopentane-1-carboxamide
CID 82764809
trans-(1S,2R)-2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314910
2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314913
2-amino-1-methyl-N-(2-pyrrolidin-1-ylethyl)cyclopentane-1-carboxamide
CID 82763901

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide (CID 130645619) is 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide is C=CCNC(=O)C1(C)CCCCC1N.
What is the InChIKey of 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide?
The InChIKey is SAVNVIVWJFKKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-8-13-10(14)11(2)7-5-4-6-9(11)12/h3,9H,1,4-8,12H2,2H3,(H,13,14).
What are the key properties of 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide?
2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide has a molecular weight of 196.29 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-prop-2-enylcyclohexane-1-carboxamide is sourced from PubChem (CID 130645619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).