N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide

C14H14N2O2S — CID 47425777

IUPACN-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
SMILESCCc1ncc(C(=O)Nc2cccc(C(C)=O)c2)s1
InChIInChI=1S/C14H14N2O2S/c1-3-13-15-8-12(19-13)14(18)16-11-6-4-5-10(7-11)9(2)17/h4-8H,3H2,1-2H3,(H,16,18)
InChIKeyHCPCOSSLTRAYKF-UHFFFAOYSA-N
MW274.35 g/mol
LogP3.16
Rot. Bonds4

About N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide

N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide (PubChem CID 47425777) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
PubChem CID47425777
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC NameN-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
SMILESCCc1ncc(C(=O)Nc2cccc(C(C)=O)c2)s1
InChIInChI=1S/C14H14N2O2S/c1-3-13-15-8-12(19-13)14(18)16-11-6-4-5-10(7-11)9(2)17/h4-8H,3H2,1-2H3,(H,16,18)
InChIKeyHCPCOSSLTRAYKF-UHFFFAOYSA-N
XLogP3.16
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-acetamido-4-methylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide
CID 48577750
N-[3-(2-ethoxyethoxymethyl)phenyl]-2-ethyl-1,3-thiazole-5-carboxamide
CID 48578355
2-ethyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide
CID 89433950
methyl N-[4-[(2-ethyl-1,3-thiazole-5-carbonyl)amino]phenyl]carbamate
CID 48578248
2-ethyl-N-[3-(2-propan-2-yloxyethoxymethyl)phenyl]-1,3-thiazole-5-carboxamide
CID 86857677
N-(3-acetylphenyl)-2-ethyl-4-methylpyrimidine-5-carboxamide
CID 53080148
N-(3-bromophenyl)-2-methyl-1,3-thiazole-5-carboxamide
CID 110862859
N-(3-carbamoylphenyl)-5-ethylthiophene-2-carboxamide
CID 47114852
N-(3-acetylphenyl)-2-(dipropylamino)pyrimidine-5-carboxamide
CID 109264701
3-N-(3-acetylphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106794
N-(3-acetylphenyl)propanamide
CID 903063
N-(3-acetylphenyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66120934

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide (CID 47425777) is N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide is CCc1ncc(C(=O)Nc2cccc(C(C)=O)c2)s1.
What is the InChIKey of N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide?
The InChIKey is HCPCOSSLTRAYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-3-13-15-8-12(19-13)14(18)16-11-6-4-5-10(7-11)9(2)17/h4-8H,3H2,1-2H3,(H,16,18).
What are the key properties of N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide?
N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide has a molecular weight of 274.35 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-ethyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 47425777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).