2-chloro-N-(1,3-thiazol-2-yl)benzamide

C10H7ClN2OS — CID 587260

IUPAC2-chloro-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1ccccc1Cl
InChIInChI=1S/C10H7ClN2OS/c11-8-4-2-1-3-7(8)9(14)13-10-12-5-6-15-10/h1-6H,(H,12,13,14)
InChIKeyWOKRBYNSYAVRFR-UHFFFAOYSA-N
MW238.70 g/mol
LogP3.05
Rot. Bonds2

About 2-chloro-N-(1,3-thiazol-2-yl)benzamide

2-chloro-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 587260) has the molecular formula C10H7ClN2OS and a molecular weight of 238.70 g/mol. Its IUPAC name is 2-chloro-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(1,3-thiazol-2-yl)benzamide
PubChem CID587260
Molecular FormulaC10H7ClN2OS
Molecular Weight238.70 g/mol
Exact Mass238.00
IUPAC Name2-chloro-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1ccccc1Cl
InChIInChI=1S/C10H7ClN2OS/c11-8-4-2-1-3-7(8)9(14)13-10-12-5-6-15-10/h1-6H,(H,12,13,14)
InChIKeyWOKRBYNSYAVRFR-UHFFFAOYSA-N
XLogP3.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.70
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-chloro-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-chloro-N-(1,3-thiazol-2-yl)benzamide (CID 587260) is 2-chloro-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-chloro-N-(1,3-thiazol-2-yl)benzamide is O=C(Nc1nccs1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is WOKRBYNSYAVRFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2OS/c11-8-4-2-1-3-7(8)9(14)13-10-12-5-6-15-10/h1-6H,(H,12,13,14).
What are the key properties of 2-chloro-N-(1,3-thiazol-2-yl)benzamide?
2-chloro-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 238.70 g/mol, XLogP of 3.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 587260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).