6-chloro-4-thiophen-2-ylpyridin-2-amine

C9H7ClN2S — CID 96614062

IUPAC6-chloro-4-thiophen-2-ylpyridin-2-amine
SMILESNc1cc(-c2cccs2)cc(Cl)n1
InChIInChI=1S/C9H7ClN2S/c10-8-4-6(5-9(11)12-8)7-2-1-3-13-7/h1-5H,(H2,11,12)
InChIKeyGSXPYOMSKJJYEF-UHFFFAOYSA-N
MW210.69 g/mol
LogP3.05
Rot. Bonds1

About 6-chloro-4-thiophen-2-ylpyridin-2-amine

6-chloro-4-thiophen-2-ylpyridin-2-amine (PubChem CID 96614062) has the molecular formula C9H7ClN2S and a molecular weight of 210.69 g/mol. Its IUPAC name is 6-chloro-4-thiophen-2-ylpyridin-2-amine.

Molecular Properties

Compound Name6-chloro-4-thiophen-2-ylpyridin-2-amine
PubChem CID96614062
Molecular FormulaC9H7ClN2S
Molecular Weight210.69 g/mol
Exact Mass210.00
IUPAC Name6-chloro-4-thiophen-2-ylpyridin-2-amine
SMILESNc1cc(-c2cccs2)cc(Cl)n1
InChIInChI=1S/C9H7ClN2S/c10-8-4-6(5-9(11)12-8)7-2-1-3-13-7/h1-5H,(H2,11,12)
InChIKeyGSXPYOMSKJJYEF-UHFFFAOYSA-N
XLogP3.05
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.69
LogP ≤ 53.05
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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Related Compounds

4-chloro-6-thiophen-2-ylpyridin-2-amine
CID 96614063
2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene
CID 25194793
2-chloro-6-cyclohexa-1,5-dien-1-yl-4-thiophen-2-ylpyridine
CID 143895726
6-chloro-8-thiophen-2-ylpyrido[3,2-d]pyrimidin-4-amine
CID 155341024
2-chloro-4-methyl-6-thiophen-2-ylpyridine
CID 142254642
2,6-bis(methylsulfanyl)-4-thiophen-2-ylpyridine
CID 14202028
4-[6-(4-chlorophenyl)-4-thiophen-2-yl-2-pyridinyl]phenol
CID 137175137
2-(7-thiophen-2-ylnaphthalen-2-yl)thiophene
CID 824515
2-(3,5-dibromophenyl)thiophene
CID 19006176
2-amino-3-methyl-5-thiophen-2-ylbenzenethiol
CID 70070727
5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)benzene-1,3-diamine
CID 107811588
2-chloro-3-methyl-5-thiophen-2-ylpyridine
CID 83814921

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-thiophen-2-ylpyridin-2-amine?
The IUPAC name of 6-chloro-4-thiophen-2-ylpyridin-2-amine (CID 96614062) is 6-chloro-4-thiophen-2-ylpyridin-2-amine.
What is the SMILES notation for 6-chloro-4-thiophen-2-ylpyridin-2-amine?
The canonical SMILES for 6-chloro-4-thiophen-2-ylpyridin-2-amine is Nc1cc(-c2cccs2)cc(Cl)n1.
What is the InChIKey of 6-chloro-4-thiophen-2-ylpyridin-2-amine?
The InChIKey is GSXPYOMSKJJYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2S/c10-8-4-6(5-9(11)12-8)7-2-1-3-13-7/h1-5H,(H2,11,12).
What are the key properties of 6-chloro-4-thiophen-2-ylpyridin-2-amine?
6-chloro-4-thiophen-2-ylpyridin-2-amine has a molecular weight of 210.69 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-thiophen-2-ylpyridin-2-amine is sourced from PubChem (CID 96614062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).