3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide

C11H10N4O2S — CID 104742045

IUPAC3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)c1ncccc1N
InChIInChI=1S/C11H10N4O2S/c12-7-2-1-4-14-8(7)10(17)15-11-6(9(13)16)3-5-18-11/h1-5H,12H2,(H2,13,16)(H,15,17)
InChIKeyXTBPLNQILMEGIR-UHFFFAOYSA-N
MW262.29 g/mol
LogP1.08
Rot. Bonds3

About 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide

3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide (PubChem CID 104742045) has the molecular formula C11H10N4O2S and a molecular weight of 262.29 g/mol. Its IUPAC name is 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide
PubChem CID104742045
Molecular FormulaC11H10N4O2S
Molecular Weight262.29 g/mol
Exact Mass262.05
IUPAC Name3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)c1ncccc1N
InChIInChI=1S/C11H10N4O2S/c12-7-2-1-4-14-8(7)10(17)15-11-6(9(13)16)3-5-18-11/h1-5H,12H2,(H2,13,16)(H,15,17)
InChIKeyXTBPLNQILMEGIR-UHFFFAOYSA-N
XLogP1.08
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-[4-(carbamoylamino)phenyl]pyridine-2-carboxamide
CID 104741358
2-[[2-(methylamino)benzoyl]amino]thiophene-3-carboxamide
CID 61377118
2-[[2-(2-aminophenyl)sulfanylacetyl]amino]thiophene-3-carboxamide
CID 43249185
2-[(2-amino-4-bromobenzoyl)amino]thiophene-3-carboxamide
CID 79721900
2-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741859
N-(3-carbamoylthiophen-2-yl)-2,5-dichloropyridine-4-carboxamide
CID 114917686
3-amino-N-(3-chloro-2-pyridinyl)pyridine-2-carboxamide
CID 103094260
2-[(2,3-dichlorobenzoyl)amino]thiophene-3-carboxamide
CID 2117879
2-[(2-aminoacetyl)amino]thiophene-3-carboxamide
CID 60641622
methyl 2-[(3-aminopyridine-2-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
CID 104742021
2-[[(2S)-2-aminobutanoyl]amino]thiophene-3-carboxamide
CID 79023007
3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide
CID 104741270

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide (CID 104742045) is 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide is NC(=O)c1ccsc1NC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide?
The InChIKey is XTBPLNQILMEGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2S/c12-7-2-1-4-14-8(7)10(17)15-11-6(9(13)16)3-5-18-11/h1-5H,12H2,(H2,13,16)(H,15,17).
What are the key properties of 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide?
3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide has a molecular weight of 262.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-carbamoylthiophen-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 104742045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).