N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide

C11H7N3OS — CID 2525612

IUPACN-(3-cyanothiophen-2-yl)pyridine-2-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1ccccn1
InChIInChI=1S/C11H7N3OS/c12-7-8-4-6-16-11(8)14-10(15)9-3-1-2-5-13-9/h1-6H,(H,14,15)
InChIKeyXNEHUAKGYXQSBF-UHFFFAOYSA-N
MW229.26 g/mol
LogP2.27
Rot. Bonds2

About N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide

N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide (PubChem CID 2525612) has the molecular formula C11H7N3OS and a molecular weight of 229.26 g/mol. Its IUPAC name is N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-cyanothiophen-2-yl)pyridine-2-carboxamide
PubChem CID2525612
Molecular FormulaC11H7N3OS
Molecular Weight229.26 g/mol
Exact Mass229.03
IUPAC NameN-(3-cyanothiophen-2-yl)pyridine-2-carboxamide
SMILESN#Cc1ccsc1NC(=O)c1ccccn1
InChIInChI=1S/C11H7N3OS/c12-7-8-4-6-16-11(8)14-10(15)9-3-1-2-5-13-9/h1-6H,(H,14,15)
InChIKeyXNEHUAKGYXQSBF-UHFFFAOYSA-N
XLogP2.27
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(pyridin-3-ylmethyl)thiophene-2-carboxamide
CID 573874
2-Thiophenecarboxamide, N-3-pyridinyl-
CID 790407
N-[1-[(3-fluoroanilino)carbonyl]-2-(3-pyridinyl)vinyl]-2-thiophenecarboxamide
CID 5370237
N-[(E)-(5-methylthiophen-2-yl)methylideneamino]pyridine-2-carboxamide
CID 6878933
Pyridine-2-carboxylic acid N'-(thiophene-2-carbonyl)-hydrazide
CID 793915
(4-Fluoro-4-{[(5-methyl-pyridin-2-ylmethyl)-amino]-methyl}-piperidin-1-yl)-thiophen-2-yl-methanone
CID 25265257
(4-Fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)(4-methylthiophen-2-yl)methanone
CID 42606104
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]pyridine-2-carboxamide
CID 84462506
N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
CID 668938
5-methyl-N-3-pyridinyl-3-thiophenecarboxamide
CID 1246640
N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]-N-(thiophen-2-ylmethyl)-2-pyridinecarboxamide
CID 3950572
N-[1-(cyclohexylamino)-2-methyl-1-oxobutan-2-yl]-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 4307489

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide (CID 2525612) is N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide is N#Cc1ccsc1NC(=O)c1ccccn1.
What is the InChIKey of N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide?
The InChIKey is XNEHUAKGYXQSBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3OS/c12-7-8-4-6-16-11(8)14-10(15)9-3-1-2-5-13-9/h1-6H,(H,14,15).
What are the key properties of N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide?
N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide has a molecular weight of 229.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanothiophen-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 2525612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).