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

C17H14N2OS — CID 58033086

IUPAC3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ncc(-c3ccccc3)s2)c1
InChIInChI=1S/C17H14N2OS/c1-12-6-5-9-14(10-12)16(20)19-17-18-11-15(21-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,19,20)
InChIKeySEOPBQAKAMYNFT-UHFFFAOYSA-N
MW294.38 g/mol
LogP4.37
Rot. Bonds3

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

3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 58033086) has the molecular formula C17H14N2OS and a molecular weight of 294.38 g/mol. Its IUPAC name is 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID58033086
Molecular FormulaC17H14N2OS
Molecular Weight294.38 g/mol
Exact Mass294.08
IUPAC Name3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ncc(-c3ccccc3)s2)c1
InChIInChI=1S/C17H14N2OS/c1-12-6-5-9-14(10-12)16(20)19-17-18-11-15(21-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,19,20)
InChIKeySEOPBQAKAMYNFT-UHFFFAOYSA-N
XLogP4.37
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(5-phenyl-1,3-thiazol-2-yl)benzamide
CID 58033062
N-[5-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]benzamide
CID 569504
N-(5-cyano-1,3-thiazol-2-yl)-3-methylbenzamide
CID 90603545
5-methyl-N-(5-phenyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
CID 47028163
3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 4191834
N-(5-phenyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 22474590
3-methyl-N-[4-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]phenyl]benzamide
CID 45020577
1-[(3-methylphenyl)methyl]-2-oxo-N-(5-phenyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 86845826
3-methyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 1080950
N-[5-(3-aminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
CID 82176812
ethane;3-methyl-N-(1-methyl-5-phenylimidazol-2-yl)benzamide
CID 145409289
3-methyl-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 17319770

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide (CID 58033086) is 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide is Cc1cccc(C(=O)Nc2ncc(-c3ccccc3)s2)c1.
What is the InChIKey of 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is SEOPBQAKAMYNFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2OS/c1-12-6-5-9-14(10-12)16(20)19-17-18-11-15(21-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,18,19,20).
What are the key properties of 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide?
3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 294.38 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(5-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 58033086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).