2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide

C9H7N3O2S2 — CID 16915451

IUPAC2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide
SMILESNC(=O)c1csc(NC(=O)c2cccs2)n1
InChIInChI=1S/C9H7N3O2S2/c10-7(13)5-4-16-9(11-5)12-8(14)6-2-1-3-15-6/h1-4H,(H2,10,13)(H,11,12,14)
InChIKeyNFCDLTXEVVYOCP-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.56
Rot. Bonds3

About 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide

2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide (PubChem CID 16915451) has the molecular formula C9H7N3O2S2 and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide
PubChem CID16915451
Molecular FormulaC9H7N3O2S2
Molecular Weight253.31 g/mol
Exact Mass253.00
IUPAC Name2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide
SMILESNC(=O)c1csc(NC(=O)c2cccs2)n1
InChIInChI=1S/C9H7N3O2S2/c10-7(13)5-4-16-9(11-5)12-8(14)6-2-1-3-15-6/h1-4H,(H2,10,13)(H,11,12,14)
InChIKeyNFCDLTXEVVYOCP-UHFFFAOYSA-N
XLogP1.56
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carbonyl]amino]propanoic acid
CID 39175981
2-(pyridine-2-carbonylamino)-1,3-thiazole-4-carboxamide
CID 110471210
N-(4-nitro-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 3139607
2-[(6-methylpyridine-2-carbonyl)amino]-1,3-thiazole-4-carboxamide
CID 110472181
2-[(3-aminobenzoyl)amino]-1,3-thiazole-4-carboxamide
CID 110474421
N-[4-[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 29369939
2-[(2-phenylacetyl)amino]-1,3-thiazole-4-carboxamide
CID 16915429
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 1240848
N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 1179161
N-[4-(2-anilino-2-oxoethyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 17414617
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 734128
N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 16820241

Frequently Asked Questions

What is the IUPAC name of 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide (CID 16915451) is 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide is NC(=O)c1csc(NC(=O)c2cccs2)n1.
What is the InChIKey of 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide?
The InChIKey is NFCDLTXEVVYOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O2S2/c10-7(13)5-4-16-9(11-5)12-8(14)6-2-1-3-15-6/h1-4H,(H2,10,13)(H,11,12,14).
What are the key properties of 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide?
2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide has a molecular weight of 253.31 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophene-2-carbonylamino)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 16915451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).