6-chloropyridine-2,3-diamine

C5H6ClN3 — CID 10630615

IUPAC6-chloropyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1N
InChIInChI=1S/C5H6ClN3/c6-4-2-1-3(7)5(8)9-4/h1-2H,7H2,(H2,8,9)
InChIKeyQEIRYIILFUVXAM-UHFFFAOYSA-N
MW143.58 g/mol
LogP0.90
Rot. Bonds

About 6-chloropyridine-2,3-diamine

6-chloropyridine-2,3-diamine (PubChem CID 10630615) has the molecular formula C5H6ClN3 and a molecular weight of 143.58 g/mol. Its IUPAC name is 6-chloropyridine-2,3-diamine.

Molecular Properties

Compound Name6-chloropyridine-2,3-diamine
PubChem CID10630615
Molecular FormulaC5H6ClN3
Molecular Weight143.58 g/mol
Exact Mass143.03
IUPAC Name6-chloropyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1N
InChIInChI=1S/C5H6ClN3/c6-4-2-1-3(7)5(8)9-4/h1-2H,7H2,(H2,8,9)
InChIKeyQEIRYIILFUVXAM-UHFFFAOYSA-N
XLogP0.90
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.58
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-chloropyridine-2,3-diamine 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

2,6-Diaminopyridine
CID 8861
Phenazopyridine hydrochloride
CID 8691
Pyridine, 3-((o-chlorophenyl)azo)-2,6-diamino-
CID 97205
2,6-Dichloro-3-pyridylamine
CID 112846
2-Amino-6-chloropyridine
CID 206246
2-Chloro-6-hydrazinopyridine
CID 320004
2-Amino-3,5-dichloro-6-methylpyridine
CID 1415863
6-Chloro-3-nitropyridin-2-ylamine
CID 2724035
2,6-Diamino-3-((2,5-dichlorophenyl)azo)pyridine
CID 97206
2,3,6-Triaminopyridine
CID 78015
Pyridine, 2-amino-6-chloro-5-nitro-
CID 3069277
5-chloro-1H,2H,3H-imidazo(4,5-b)pyridin-2-one
CID 20587804

Frequently Asked Questions

What is the IUPAC name of 6-chloropyridine-2,3-diamine?
The IUPAC name of 6-chloropyridine-2,3-diamine (CID 10630615) is 6-chloropyridine-2,3-diamine.
What is the SMILES notation for 6-chloropyridine-2,3-diamine?
The canonical SMILES for 6-chloropyridine-2,3-diamine is Nc1ccc(Cl)nc1N.
What is the InChIKey of 6-chloropyridine-2,3-diamine?
The InChIKey is QEIRYIILFUVXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6ClN3/c6-4-2-1-3(7)5(8)9-4/h1-2H,7H2,(H2,8,9).
What are the key properties of 6-chloropyridine-2,3-diamine?
6-chloropyridine-2,3-diamine has a molecular weight of 143.58 g/mol, XLogP of 0.90, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloropyridine-2,3-diamine is sourced from PubChem (CID 10630615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).