(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone

C10H6ClNOS — CID 53401492

IUPAC(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)c1ccc(Cl)s1
InChIInChI=1S/C10H6ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6H
InChIKeyWNEVRSJPSKDNJK-UHFFFAOYSA-N
MW223.68 g/mol
LogP3.03
Rot. Bonds2

About (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone

(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone (PubChem CID 53401492) has the molecular formula C10H6ClNOS and a molecular weight of 223.68 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone
PubChem CID53401492
Molecular FormulaC10H6ClNOS
Molecular Weight223.68 g/mol
Exact Mass222.99
IUPAC Name(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)c1ccc(Cl)s1
InChIInChI=1S/C10H6ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6H
InChIKeyWNEVRSJPSKDNJK-UHFFFAOYSA-N
XLogP3.03
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.68
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone 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

(5-chlorothiophen-2-yl)-(1,3-thiazol-4-yl)methanone
CID 78923566
(5-chlorothiophen-2-yl)-(2-methyl-3-pyridinyl)methanone
CID 105122606
pyridin-2-yl(1,3-thiazol-5-yl)methanone
CID 141075221
(2-methoxy-1,3-thiazol-5-yl)-pyridin-2-ylmethanone
CID 130593048
(3,5-dichlorophenyl)-pyridin-2-ylmethanone
CID 24723586
(5-chlorothiophen-2-yl)-[2-(methylamino)-1,3-thiazol-4-yl]methanone
CID 82132569
CID 173156131
CID 173156131
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 4968210
(2,5-dichlorophenyl)-pyridin-2-ylmethanone
CID 16638529
N-[(5-chlorothiophen-2-yl)methyl]-N-ethylpyridine-2-carboxamide
CID 39911714
ethane;pyridine-2-carbonyl chloride
CID 158598971
copper;bis(pyridin-2-yl(thiophen-2-yl)methanone);ditetrafluoroborate;dihydrate
CID 139055886

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone?
The IUPAC name of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone (CID 53401492) is (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone.
What is the SMILES notation for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone?
The canonical SMILES for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone is O=C(c1ccccn1)c1ccc(Cl)s1.
What is the InChIKey of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone?
The InChIKey is WNEVRSJPSKDNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClNOS/c11-9-5-4-8(14-9)10(13)7-3-1-2-6-12-7/h1-6H.
What are the key properties of (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone?
(5-chlorothiophen-2-yl)-pyridin-2-ylmethanone has a molecular weight of 223.68 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-pyridin-2-ylmethanone is sourced from PubChem (CID 53401492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).