2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide

C16H18N4O2S — CID 95807341

IUPAC2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(=O)n(Cc2cccs2)c2ncccc21
InChIInChI=1S/C16H18N4O2S/c1-11(2)18-14(21)10-19-13-6-3-7-17-15(13)20(16(19)22)9-12-5-4-8-23-12/h3-8,11H,9-10H2,1-2H3,(H,18,21)
InChIKeyWNWBMEYMKWKQFQ-UHFFFAOYSA-N
MW330.41 g/mol
LogP1.83
Rot. Bonds5

About 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide

2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide (PubChem CID 95807341) has the molecular formula C16H18N4O2S and a molecular weight of 330.41 g/mol. Its IUPAC name is 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide
PubChem CID95807341
Molecular FormulaC16H18N4O2S
Molecular Weight330.41 g/mol
Exact Mass330.12
IUPAC Name2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(=O)n(Cc2cccs2)c2ncccc21
InChIInChI=1S/C16H18N4O2S/c1-11(2)18-14(21)10-19-13-6-3-7-17-15(13)20(16(19)22)9-12-5-4-8-23-12/h3-8,11H,9-10H2,1-2H3,(H,18,21)
InChIKeyWNWBMEYMKWKQFQ-UHFFFAOYSA-N
XLogP1.83
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide 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

1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-2-one
CID 16668989
2-(3-cyclopentyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-propan-2-ylacetamide
CID 53159374
2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide
CID 71841477
2-[2,4-dioxo-3-(thiophen-2-ylmethyl)pyrido[3,2-d]pyrimidin-1-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 16841958
N-(4-butylphenyl)-2-[2,4-dioxo-3-(thiophen-2-ylmethyl)pyrido[3,2-d]pyrimidin-1-yl]acetamide
CID 16841925
2-[4-[(4-methylphenyl)methyl]-2,3-dioxopyrido[2,3-b]pyrazin-1-yl]-N-(1-thiophen-2-ylbutyl)acetamide
CID 53030682
2-(2-oxo-3-phenylimidazo[4,5-b]pyridin-1-yl)-N-(1-pyridin-2-ylethyl)acetamide
CID 53200902
2-(4-benzyl-2,3-dioxopyrido[2,3-b]pyrazin-1-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 53001145
2-[2,3-dioxo-4-(pyridin-4-ylmethyl)pyrido[2,3-b]pyrazin-1-yl]-N-(4-phenylbutan-2-yl)acetamide
CID 53001231
2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-(1-phenylethyl)acetamide
CID 71841464
2-(4-ethyl-2,3-dioxopyrido[2,3-b]pyrazin-1-yl)-N-[(2S)-1-(furan-2-yl)propan-2-yl]acetamide
CID 93060408
2-(4-methyl-2,3-dioxopyrido[2,3-b]pyrazin-1-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 53001038

Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide (CID 95807341) is 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1c(=O)n(Cc2cccs2)c2ncccc21.
What is the InChIKey of 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide?
The InChIKey is WNWBMEYMKWKQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2S/c1-11(2)18-14(21)10-19-13-6-3-7-17-15(13)20(16(19)22)9-12-5-4-8-23-12/h3-8,11H,9-10H2,1-2H3,(H,18,21).
What are the key properties of 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide?
2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide has a molecular weight of 330.41 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 95807341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).