5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine

C10H9ClN4 — CID 171355336

IUPAC5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine
SMILESNc1ccc(-c2cnc(Cl)c(N)c2)cn1
InChIInChI=1S/C10H9ClN4/c11-10-8(12)3-7(5-15-10)6-1-2-9(13)14-4-6/h1-5H,12H2,(H2,13,14)
InChIKeyFHARCAKMRAVLEB-UHFFFAOYSA-N
MW220.66 g/mol
LogP1.96
Rot. Bonds1

About 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine

5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine (PubChem CID 171355336) has the molecular formula C10H9ClN4 and a molecular weight of 220.66 g/mol. Its IUPAC name is 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine.

Molecular Properties

Compound Name5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine
PubChem CID171355336
Molecular FormulaC10H9ClN4
Molecular Weight220.66 g/mol
Exact Mass220.05
IUPAC Name5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine
SMILESNc1ccc(-c2cnc(Cl)c(N)c2)cn1
InChIInChI=1S/C10H9ClN4/c11-10-8(12)3-7(5-15-10)6-1-2-9(13)14-4-6/h1-5H,12H2,(H2,13,14)
InChIKeyFHARCAKMRAVLEB-UHFFFAOYSA-N
XLogP1.96
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine 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 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine?
The IUPAC name of 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine (CID 171355336) is 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine.
What is the SMILES notation for 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine?
The canonical SMILES for 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine is Nc1ccc(-c2cnc(Cl)c(N)c2)cn1.
What is the InChIKey of 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine?
The InChIKey is FHARCAKMRAVLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4/c11-10-8(12)3-7(5-15-10)6-1-2-9(13)14-4-6/h1-5H,12H2,(H2,13,14).
What are the key properties of 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine?
5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine has a molecular weight of 220.66 g/mol, XLogP of 1.96, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-amino-3-pyridinyl)-2-chloropyridin-3-amine is sourced from PubChem (CID 171355336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).