2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide

C14H11N3O2S3 — CID 54582187

IUPAC2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)Cc1nc(-c2cccs2)cs1
InChIInChI=1S/C14H11N3O2S3/c15-13(19)8-3-5-21-14(8)17-11(18)6-12-16-9(7-22-12)10-2-1-4-20-10/h1-5,7H,6H2,(H2,15,19)(H,17,18)
InChIKeyWTZFNLYUBGXNSF-UHFFFAOYSA-N
MW349.46 g/mol
LogP3.21
Rot. Bonds5

About 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide

2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide (PubChem CID 54582187) has the molecular formula C14H11N3O2S3 and a molecular weight of 349.46 g/mol. Its IUPAC name is 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide
PubChem CID54582187
Molecular FormulaC14H11N3O2S3
Molecular Weight349.46 g/mol
Exact Mass349.00
IUPAC Name2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)Cc1nc(-c2cccs2)cs1
InChIInChI=1S/C14H11N3O2S3/c15-13(19)8-3-5-21-14(8)17-11(18)6-12-16-9(7-22-12)10-2-1-4-20-10/h1-5,7H,6H2,(H2,15,19)(H,17,18)
InChIKeyWTZFNLYUBGXNSF-UHFFFAOYSA-N
XLogP3.21
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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2-[(2-naphthalen-2-ylacetyl)amino]thiophene-3-carboxamide
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2-[(2-aminoacetyl)amino]thiophene-3-carboxamide
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CID 54585084
2-[[2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxamide
CID 16607409
2-[(2-phenoxyacetyl)amino]thiophene-3-carboxamide
CID 1246150
[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] quinoline-2-carboxylate
CID 3481111
4-amino-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pentanamide
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2-(2-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
CID 2080859
2-(2-methyl-1,3-thiazol-4-yl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide (CID 54582187) is 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide is NC(=O)c1ccsc1NC(=O)Cc1nc(-c2cccs2)cs1.
What is the InChIKey of 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide?
The InChIKey is WTZFNLYUBGXNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S3/c15-13(19)8-3-5-21-14(8)17-11(18)6-12-16-9(7-22-12)10-2-1-4-20-10/h1-5,7H,6H2,(H2,15,19)(H,17,18).
What are the key properties of 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide?
2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide has a molecular weight of 349.46 g/mol, XLogP of 3.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 54582187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).