4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile

C9H9N3O — CID 105436013

IUPAC4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(N)cc(C2CC2)[nH]c1=O
InChIInChI=1S/C9H9N3O/c10-4-6-7(11)3-8(5-1-2-5)12-9(6)13/h3,5H,1-2H2,(H3,11,12,13)
InChIKeyOJOAUYRBKARILM-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.71
Rot. Bonds1

About 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile

4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile (PubChem CID 105436013) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile
PubChem CID105436013
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile
SMILESN#Cc1c(N)cc(C2CC2)[nH]c1=O
InChIInChI=1S/C9H9N3O/c10-4-6-7(11)3-8(5-1-2-5)12-9(6)13/h3,5H,1-2H2,(H3,11,12,13)
InChIKeyOJOAUYRBKARILM-UHFFFAOYSA-N
XLogP0.71
TPSA82.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile 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 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile?
The IUPAC name of 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile (CID 105436013) is 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile.
What is the SMILES notation for 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile?
The canonical SMILES for 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile is N#Cc1c(N)cc(C2CC2)[nH]c1=O.
What is the InChIKey of 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile?
The InChIKey is OJOAUYRBKARILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c10-4-6-7(11)3-8(5-1-2-5)12-9(6)13/h3,5H,1-2H2,(H3,11,12,13).
What are the key properties of 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile?
4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile has a molecular weight of 175.19 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-cyclopropyl-2-oxo-1H-pyridine-3-carbonitrile is sourced from PubChem (CID 105436013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).