4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide

C7H9ClN4O — CID 90192665

IUPAC4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1nc(Cl)cc(N)c1C(N)=O
InChIInChI=1S/C7H9ClN4O/c1-11-7-5(6(10)13)3(9)2-4(8)12-7/h2H,1H3,(H2,10,13)(H3,9,11,12)
InChIKeyWKZLRRCVZRDGFR-UHFFFAOYSA-N
MW200.63 g/mol
LogP0.46
Rot. Bonds2

About 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide

4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide (PubChem CID 90192665) has the molecular formula C7H9ClN4O and a molecular weight of 200.63 g/mol. Its IUPAC name is 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide
PubChem CID90192665
Molecular FormulaC7H9ClN4O
Molecular Weight200.63 g/mol
Exact Mass200.05
IUPAC Name4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide
SMILESCNc1nc(Cl)cc(N)c1C(N)=O
InChIInChI=1S/C7H9ClN4O/c1-11-7-5(6(10)13)3(9)2-4(8)12-7/h2H,1H3,(H2,10,13)(H3,9,11,12)
InChIKeyWKZLRRCVZRDGFR-UHFFFAOYSA-N
XLogP0.46
TPSA94.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.63
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-amino-6-chloro-2-(methylamino)pyridine-3-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 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide (CID 90192665) is 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide is CNc1nc(Cl)cc(N)c1C(N)=O.
What is the InChIKey of 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide?
The InChIKey is WKZLRRCVZRDGFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN4O/c1-11-7-5(6(10)13)3(9)2-4(8)12-7/h2H,1H3,(H2,10,13)(H3,9,11,12).
What are the key properties of 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide?
4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide has a molecular weight of 200.63 g/mol, XLogP of 0.46, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-chloro-2-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 90192665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).