2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide

C13H13N3O2S — CID 16914905

IUPAC2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(NC(=O)c2ccccc2)n1
InChIInChI=1S/C13H13N3O2S/c1-2-14-12(18)10-8-19-13(15-10)16-11(17)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,18)(H,15,16,17)
InChIKeyLIOBWYVFESYIBT-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.15
Rot. Bonds4

About 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide

2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide (PubChem CID 16914905) has the molecular formula C13H13N3O2S and a molecular weight of 275.33 g/mol. Its IUPAC name is 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide
PubChem CID16914905
Molecular FormulaC13H13N3O2S
Molecular Weight275.33 g/mol
Exact Mass275.07
IUPAC Name2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(NC(=O)c2ccccc2)n1
InChIInChI=1S/C13H13N3O2S/c1-2-14-12(18)10-8-19-13(15-10)16-11(17)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,18)(H,15,16,17)
InChIKeyLIOBWYVFESYIBT-UHFFFAOYSA-N
XLogP2.15
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-benzamido-N-benzyl-1,3-thiazole-4-carboxamide
CID 16914921
4-[(2-benzamido-1,3-thiazole-4-carbonyl)amino]butanoic acid
CID 39182218
N-[4-(2-benzamido-1,3-thiazol-4-yl)-1,3-thiazol-2-yl]benzamide
CID 4294892
2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide
CID 16915665
2-benzamido-N-(2,6-dimethylphenyl)-1,3-thiazole-4-carboxamide
CID 16914979
2-benzamido-N,N-bis(2-methoxyethyl)-1,3-thiazole-4-carboxamide
CID 16914887
N-benzyl-2-[(4-methoxybenzoyl)amino]-1,3-thiazole-4-carboxamide
CID 84555626
N-ethyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 17398194
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 735075
2-[(4-chlorobenzoyl)amino]-N-phenyl-1,3-thiazole-4-carboxamide
CID 16915094
N-[4-(3-phenylprop-2-enoyl)-1,3-thiazol-2-yl]benzamide
CID 174923780
2-benzamido-N-(4-phenoxyphenyl)-1,3-thiazole-4-carboxamide
CID 16914969

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide (CID 16914905) is 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide is CCNC(=O)c1csc(NC(=O)c2ccccc2)n1.
What is the InChIKey of 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide?
The InChIKey is LIOBWYVFESYIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2S/c1-2-14-12(18)10-8-19-13(15-10)16-11(17)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,18)(H,15,16,17).
What are the key properties of 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide?
2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide has a molecular weight of 275.33 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 16914905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).