2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide

C15H17N3O3S — CID 16915665

IUPAC2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(NC(=O)c2ccccc2OCC)n1
InChIInChI=1S/C15H17N3O3S/c1-3-16-14(20)11-9-22-15(17-11)18-13(19)10-7-5-6-8-12(10)21-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,18,19)
InChIKeyHRVQXFJICXYHQR-UHFFFAOYSA-N
MW319.39 g/mol
LogP2.54
Rot. Bonds6

About 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide

2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide (PubChem CID 16915665) has the molecular formula C15H17N3O3S and a molecular weight of 319.39 g/mol. Its IUPAC name is 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide
PubChem CID16915665
Molecular FormulaC15H17N3O3S
Molecular Weight319.39 g/mol
Exact Mass319.10
IUPAC Name2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide
SMILESCCNC(=O)c1csc(NC(=O)c2ccccc2OCC)n1
InChIInChI=1S/C15H17N3O3S/c1-3-16-14(20)11-9-22-15(17-11)18-13(19)10-7-5-6-8-12(10)21-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,18,19)
InChIKeyHRVQXFJICXYHQR-UHFFFAOYSA-N
XLogP2.54
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-benzamido-N-ethyl-1,3-thiazole-4-carboxamide
CID 16914905
N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-ethoxybenzamide
CID 1220261
N-[2-(dimethylamino)ethyl]-2-[(2-methoxybenzoyl)amino]-1,3-thiazole-4-carboxamide
CID 19611237
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 735075
N-[4-[(4-cyclopropyl-1,3-thiazol-2-yl)amino]-4-oxobutyl]-2-ethoxybenzamide
CID 32867568
2-ethoxy-N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]benzamide
CID 18143742
2-ethoxy-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 30547705
2-[(3,5-dimethoxybenzoyl)amino]-N-(2-ethoxyphenyl)-1,3-thiazole-4-carboxamide
CID 16915265
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
ethyl 2-[2-[[2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoyl]amino]-1,3-thiazol-4-yl]acetate
CID 24599388
N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyethoxy)benzamide
CID 60564262
2-ethoxy-N-[4-[[(3R)-3-methylpiperidin-1-yl]methyl]-1,3-thiazol-2-yl]benzamide
CID 35844295

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide (CID 16915665) is 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide is CCNC(=O)c1csc(NC(=O)c2ccccc2OCC)n1.
What is the InChIKey of 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide?
The InChIKey is HRVQXFJICXYHQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3S/c1-3-16-14(20)11-9-22-15(17-11)18-13(19)10-7-5-6-8-12(10)21-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,18,19).
What are the key properties of 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide?
2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide has a molecular weight of 319.39 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethoxybenzoyl)amino]-N-ethyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 16915665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).