2-(5-chlorothiophen-2-yl)pyridin-3-amine

C9H7ClN2S — CID 75481766

IUPAC2-(5-chlorothiophen-2-yl)pyridin-3-amine
SMILESNc1cccnc1-c1ccc(Cl)s1
InChIInChI=1S/C9H7ClN2S/c10-8-4-3-7(13-8)9-6(11)2-1-5-12-9/h1-5H,11H2
InChIKeyJCTUHMGHJHEGFF-UHFFFAOYSA-N
MW210.69 g/mol
LogP3.05
Rot. Bonds1

About 2-(5-chlorothiophen-2-yl)pyridin-3-amine

2-(5-chlorothiophen-2-yl)pyridin-3-amine (PubChem CID 75481766) has the molecular formula C9H7ClN2S and a molecular weight of 210.69 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)pyridin-3-amine
PubChem CID75481766
Molecular FormulaC9H7ClN2S
Molecular Weight210.69 g/mol
Exact Mass210.00
IUPAC Name2-(5-chlorothiophen-2-yl)pyridin-3-amine
SMILESNc1cccnc1-c1ccc(Cl)s1
InChIInChI=1S/C9H7ClN2S/c10-8-4-3-7(13-8)9-6(11)2-1-5-12-9/h1-5H,11H2
InChIKeyJCTUHMGHJHEGFF-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

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)pyridin-3-amine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)pyridin-3-amine (CID 75481766) is 2-(5-chlorothiophen-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)pyridin-3-amine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)pyridin-3-amine is Nc1cccnc1-c1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)pyridin-3-amine?
The InChIKey is JCTUHMGHJHEGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2S/c10-8-4-3-7(13-8)9-6(11)2-1-5-12-9/h1-5H,11H2.
What are the key properties of 2-(5-chlorothiophen-2-yl)pyridin-3-amine?
2-(5-chlorothiophen-2-yl)pyridin-3-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 2-(5-chlorothiophen-2-yl)pyridin-3-amine is sourced from PubChem (CID 75481766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).