2-(2-phenyl-1,3-thiazol-5-yl)benzamide

C16H12N2OS — CID 174783115

IUPAC2-(2-phenyl-1,3-thiazol-5-yl)benzamide
SMILESNC(=O)c1ccccc1-c1cnc(-c2ccccc2)s1
InChIInChI=1S/C16H12N2OS/c17-15(19)13-9-5-4-8-12(13)14-10-18-16(20-14)11-6-2-1-3-7-11/h1-10H,(H2,17,19)
InChIKeyBRISKLRCOZMJAK-UHFFFAOYSA-N
MW280.35 g/mol
LogP3.58
Rot. Bonds3

About 2-(2-phenyl-1,3-thiazol-5-yl)benzamide

2-(2-phenyl-1,3-thiazol-5-yl)benzamide (PubChem CID 174783115) has the molecular formula C16H12N2OS and a molecular weight of 280.35 g/mol. Its IUPAC name is 2-(2-phenyl-1,3-thiazol-5-yl)benzamide.

Molecular Properties

Compound Name2-(2-phenyl-1,3-thiazol-5-yl)benzamide
PubChem CID174783115
Molecular FormulaC16H12N2OS
Molecular Weight280.35 g/mol
Exact Mass280.07
IUPAC Name2-(2-phenyl-1,3-thiazol-5-yl)benzamide
SMILESNC(=O)c1ccccc1-c1cnc(-c2ccccc2)s1
InChIInChI=1S/C16H12N2OS/c17-15(19)13-9-5-4-8-12(13)14-10-18-16(20-14)11-6-2-1-3-7-11/h1-10H,(H2,17,19)
InChIKeyBRISKLRCOZMJAK-UHFFFAOYSA-N
XLogP3.58
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-1,3-thiazol-5-yl)benzamide?
The IUPAC name of 2-(2-phenyl-1,3-thiazol-5-yl)benzamide (CID 174783115) is 2-(2-phenyl-1,3-thiazol-5-yl)benzamide.
What is the SMILES notation for 2-(2-phenyl-1,3-thiazol-5-yl)benzamide?
The canonical SMILES for 2-(2-phenyl-1,3-thiazol-5-yl)benzamide is NC(=O)c1ccccc1-c1cnc(-c2ccccc2)s1.
What is the InChIKey of 2-(2-phenyl-1,3-thiazol-5-yl)benzamide?
The InChIKey is BRISKLRCOZMJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2OS/c17-15(19)13-9-5-4-8-12(13)14-10-18-16(20-14)11-6-2-1-3-7-11/h1-10H,(H2,17,19).
What are the key properties of 2-(2-phenyl-1,3-thiazol-5-yl)benzamide?
2-(2-phenyl-1,3-thiazol-5-yl)benzamide has a molecular weight of 280.35 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-1,3-thiazol-5-yl)benzamide is sourced from PubChem (CID 174783115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).