N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide

C9H13NO — CID 139030439

IUPACN-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide
SMILESCNC(=O)C1=CC2CCC1C2
InChIInChI=1S/C9H13NO/c1-10-9(11)8-5-6-2-3-7(8)4-6/h5-7H,2-4H2,1H3,(H,10,11)
InChIKeyBYXAMVZFVXOYIF-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.09
Rot. Bonds1

About N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide

N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide (PubChem CID 139030439) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide.

Molecular Properties

Compound NameN-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide
PubChem CID139030439
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC NameN-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide
SMILESCNC(=O)C1=CC2CCC1C2
InChIInChI=1S/C9H13NO/c1-10-9(11)8-5-6-2-3-7(8)4-6/h5-7H,2-4H2,1H3,(H,10,11)
InChIKeyBYXAMVZFVXOYIF-UHFFFAOYSA-N
XLogP1.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-methylbicyclo[2.2.1]hept-2-ene-2-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

N-methylcyclohexene-1-carboxamide
CID 12587286
N-methylbicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 3438395
Bicyclo[2.2.1]hept-2-ene-2-carboxamide
CID 45084041
N,N-Dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
CID 86131923
4-fluoro-N,5-dimethylcyclohexene-1-carboxamide
CID 70191204
N,N-diethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
CID 139030414
N-isopropylbicyclo[2.2.1]hept-2-ene-2-carboxamide
CID 139030419
N,1-dimethylbicyclo[2.2.1]hept-2-ene-2-carboxamide
CID 139030440
(6S)-4-fluoro-N-methyl-6-(trifluoromethyl)cyclohexene-1-carboxamide
CID 147682958
N,6-dimethyl-3-(trifluoromethyl)cyclohexene-1-carboxamide
CID 159188210
4-fluoro-N-methyl-6-(trifluoromethyl)cyclohexene-1-carboxamide
CID 162577247
6-hexyl-N-methylcyclohexene-1-carboxamide
CID 12587289

Frequently Asked Questions

What is the IUPAC name of N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The IUPAC name of N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide (CID 139030439) is N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide.
What is the SMILES notation for N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The canonical SMILES for N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide is CNC(=O)C1=CC2CCC1C2.
What is the InChIKey of N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
The InChIKey is BYXAMVZFVXOYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-10-9(11)8-5-6-2-3-7(8)4-6/h5-7H,2-4H2,1H3,(H,10,11).
What are the key properties of N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide?
N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide has a molecular weight of 151.21 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylbicyclo[2.2.1]hept-2-ene-2-carboxamide is sourced from PubChem (CID 139030439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).