2-cyano-N-methylcyclopentene-1-carboxamide

C8H10N2O — CID 131201219

IUPAC2-cyano-N-methylcyclopentene-1-carboxamide
SMILESCNC(=O)C1=C(C#N)CCC1
InChIInChI=1S/C8H10N2O/c1-10-8(11)7-4-2-3-6(7)5-9/h2-4H2,1H3,(H,10,11)
InChIKeyDWJHPIYYWYBXCW-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.74
Rot. Bonds1

About 2-cyano-N-methylcyclopentene-1-carboxamide

2-cyano-N-methylcyclopentene-1-carboxamide (PubChem CID 131201219) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 2-cyano-N-methylcyclopentene-1-carboxamide.

Molecular Properties

Compound Name2-cyano-N-methylcyclopentene-1-carboxamide
PubChem CID131201219
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name2-cyano-N-methylcyclopentene-1-carboxamide
SMILESCNC(=O)C1=C(C#N)CCC1
InChIInChI=1S/C8H10N2O/c1-10-8(11)7-4-2-3-6(7)5-9/h2-4H2,1H3,(H,10,11)
InChIKeyDWJHPIYYWYBXCW-UHFFFAOYSA-N
XLogP0.74
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyano-N-methylcyclopentene-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

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-methylcyclopentene-1-carboxamide?
The IUPAC name of 2-cyano-N-methylcyclopentene-1-carboxamide (CID 131201219) is 2-cyano-N-methylcyclopentene-1-carboxamide.
What is the SMILES notation for 2-cyano-N-methylcyclopentene-1-carboxamide?
The canonical SMILES for 2-cyano-N-methylcyclopentene-1-carboxamide is CNC(=O)C1=C(C#N)CCC1.
What is the InChIKey of 2-cyano-N-methylcyclopentene-1-carboxamide?
The InChIKey is DWJHPIYYWYBXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10-8(11)7-4-2-3-6(7)5-9/h2-4H2,1H3,(H,10,11).
What are the key properties of 2-cyano-N-methylcyclopentene-1-carboxamide?
2-cyano-N-methylcyclopentene-1-carboxamide has a molecular weight of 150.18 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-methylcyclopentene-1-carboxamide is sourced from PubChem (CID 131201219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).