6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine

C10H8ClN3S — CID 115474582

IUPAC6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine
SMILESNc1ccc(Cl)nc1Sc1ccccn1
InChIInChI=1S/C10H8ClN3S/c11-8-5-4-7(12)10(14-8)15-9-3-1-2-6-13-9/h1-6H,12H2
InChIKeyBMILJVSCWUOMGF-UHFFFAOYSA-N
MW237.72 g/mol
LogP2.86
Rot. Bonds2

About 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine

6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine (PubChem CID 115474582) has the molecular formula C10H8ClN3S and a molecular weight of 237.72 g/mol. Its IUPAC name is 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine
PubChem CID115474582
Molecular FormulaC10H8ClN3S
Molecular Weight237.72 g/mol
Exact Mass237.01
IUPAC Name6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine
SMILESNc1ccc(Cl)nc1Sc1ccccn1
InChIInChI=1S/C10H8ClN3S/c11-8-5-4-7(12)10(14-8)15-9-3-1-2-6-13-9/h1-6H,12H2
InChIKeyBMILJVSCWUOMGF-UHFFFAOYSA-N
XLogP2.86
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.72
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-chloro-2-pyridin-2-ylsulfanylpyridin-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

Related Compounds

2-(2-bromophenyl)sulfanyl-6-chloropyridin-3-amine
CID 115474601
6-chloro-2-(1,3-thiazol-2-ylsulfanyl)pyridin-3-amine
CID 115474613
6-chloro-2-thiophen-2-ylsulfanylpyridin-3-amine
CID 115474595
2-chloro-6-(pyridin-2-yldisulfanyl)pyridine
CID 91874893
4-chloro-2-methyl-6-pyridin-2-ylsulfanylpyrimidine
CID 62482152
6-chloro-2-N-pyridin-2-ylpyridine-2,3-diamine
CID 53486868
5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine
CID 104507614
3-chloro-4,5-dimethyl-6-pyridin-2-ylsulfanylpyridazine
CID 63272351
6-methylsulfanyl-2-pyridin-2-ylsulfanylpyrimidin-4-amine
CID 152655143
2-chloro-6-pyridin-2-ylsulfanylpyridine-4-carbothioamide
CID 2799916
5-chloro-4-pyridin-2-ylsulfanyl-1H-pyrimidin-6-one
CID 114791008
3-methyl-2-pyridin-2-ylsulfanylaniline
CID 115551231

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine?
The IUPAC name of 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine (CID 115474582) is 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine.
What is the SMILES notation for 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine?
The canonical SMILES for 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine is Nc1ccc(Cl)nc1Sc1ccccn1.
What is the InChIKey of 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine?
The InChIKey is BMILJVSCWUOMGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3S/c11-8-5-4-7(12)10(14-8)15-9-3-1-2-6-13-9/h1-6H,12H2.
What are the key properties of 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine?
6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine has a molecular weight of 237.72 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine is sourced from PubChem (CID 115474582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).