2-chloro-4-pyridin-2-ylpyridin-3-amine

C10H8ClN3 — CID 82396148

IUPAC2-chloro-4-pyridin-2-ylpyridin-3-amine
SMILESNc1c(-c2ccccn2)ccnc1Cl
InChIInChI=1S/C10H8ClN3/c11-10-9(12)7(4-6-14-10)8-3-1-2-5-13-8/h1-6H,12H2
InChIKeyLCVZATMTGCSGDU-UHFFFAOYSA-N
MW205.65 g/mol
LogP2.38
Rot. Bonds1

About 2-chloro-4-pyridin-2-ylpyridin-3-amine

2-chloro-4-pyridin-2-ylpyridin-3-amine (PubChem CID 82396148) has the molecular formula C10H8ClN3 and a molecular weight of 205.65 g/mol. Its IUPAC name is 2-chloro-4-pyridin-2-ylpyridin-3-amine.

Molecular Properties

Compound Name2-chloro-4-pyridin-2-ylpyridin-3-amine
PubChem CID82396148
Molecular FormulaC10H8ClN3
Molecular Weight205.65 g/mol
Exact Mass205.04
IUPAC Name2-chloro-4-pyridin-2-ylpyridin-3-amine
SMILESNc1c(-c2ccccn2)ccnc1Cl
InChIInChI=1S/C10H8ClN3/c11-10-9(12)7(4-6-14-10)8-3-1-2-5-13-8/h1-6H,12H2
InChIKeyLCVZATMTGCSGDU-UHFFFAOYSA-N
XLogP2.38
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.65
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The IUPAC name of 2-chloro-4-pyridin-2-ylpyridin-3-amine (CID 82396148) is 2-chloro-4-pyridin-2-ylpyridin-3-amine.
What is the SMILES notation for 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The canonical SMILES for 2-chloro-4-pyridin-2-ylpyridin-3-amine is Nc1c(-c2ccccn2)ccnc1Cl.
What is the InChIKey of 2-chloro-4-pyridin-2-ylpyridin-3-amine?
The InChIKey is LCVZATMTGCSGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3/c11-10-9(12)7(4-6-14-10)8-3-1-2-5-13-8/h1-6H,12H2.
What are the key properties of 2-chloro-4-pyridin-2-ylpyridin-3-amine?
2-chloro-4-pyridin-2-ylpyridin-3-amine has a molecular weight of 205.65 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-pyridin-2-ylpyridin-3-amine is sourced from PubChem (CID 82396148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).