2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

C17H14N2OS — CID 576996

IUPAC2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H14N2OS/c1-12-7-5-6-10-14(12)16(20)19-17-18-15(11-21-17)13-8-3-2-4-9-13/h2-11H,1H3,(H,18,19,20)
InChIKeyRDJMMDYRUBMLRL-UHFFFAOYSA-N
MW294.38 g/mol
LogP4.37
Rot. Bonds3

About 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide

2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (PubChem CID 576996) has the molecular formula C17H14N2OS and a molecular weight of 294.38 g/mol. Its IUPAC name is 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
PubChem CID576996
Molecular FormulaC17H14N2OS
Molecular Weight294.38 g/mol
Exact Mass294.08
IUPAC Name2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H14N2OS/c1-12-7-5-6-10-14(12)16(20)19-17-18-15(11-21-17)13-8-3-2-4-9-13/h2-11H,1H3,(H,18,19,20)
InChIKeyRDJMMDYRUBMLRL-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

N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-methylbenzamide
CID 19195032
2-methylsulfanyl-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 41154127
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-methylbenzamide
CID 861896
N-[4-[4-(3-acetamidopropyl)phenyl]-1,3-thiazol-2-yl]-2-methylbenzamide
CID 36531308
[2-oxo-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl] 2-methylbenzoate
CID 23989459
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-phenyl-1H-pyrrole-3-carboxamide
CID 56930773
2-methyl-N-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]-N-propylbenzamide
CID 1058209
2-methyl-N-[3-[2-(2-methylanilino)-1,3-thiazol-4-yl]phenyl]benzamide
CID 3418788
2,4-dimethyl-N-(4-phenyl-1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide
CID 16644283
1-N,2-N-bis[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]benzene-1,2-dicarboxamide
CID 5237170
4-bromo-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 988802

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide (CID 576996) is 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is Cc1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is RDJMMDYRUBMLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2OS/c1-12-7-5-6-10-14(12)16(20)19-17-18-15(11-21-17)13-8-3-2-4-9-13/h2-11H,1H3,(H,18,19,20).
What are the key properties of 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide?
2-methyl-N-(4-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 2-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 576996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).