3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide

C11H11N3OS — CID 104742298

IUPAC3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
SMILESNc1cccnc1C(=O)NCc1ccsc1
InChIInChI=1S/C11H11N3OS/c12-9-2-1-4-13-10(9)11(15)14-6-8-3-5-16-7-8/h1-5,7H,6,12H2,(H,14,15)
InChIKeyASMFPVFVYOHJNN-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.66
Rot. Bonds3

About 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide

3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 104742298) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
PubChem CID104742298
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC Name3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
SMILESNc1cccnc1C(=O)NCc1ccsc1
InChIInChI=1S/C11H11N3OS/c12-9-2-1-4-13-10(9)11(15)14-6-8-3-5-16-7-8/h1-5,7H,6,12H2,(H,14,15)
InChIKeyASMFPVFVYOHJNN-UHFFFAOYSA-N
XLogP1.66
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 107358701
3-amino-N-(pyridazin-3-ylmethyl)pyridine-2-carboxamide
CID 106896014
3-amino-N-[[4-(dimethylamino)phenyl]methyl]pyridine-2-carboxamide
CID 104741972
2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 63247950
3-amino-N-(1-thiophen-3-ylethyl)pyridine-2-carboxamide
CID 104742232
2-amino-3-fluoro-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
CID 105386232
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
6-hydrazinyl-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
CID 63248051
3-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 104741450
3-amino-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide
CID 113447693
3-amino-N-(2,2-difluoroethyl)pyridine-2-carboxamide
CID 104742724
3-amino-N-(2,2-dichloroethyl)pyridine-2-carboxamide
CID 130551892

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide (CID 104742298) is 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide is Nc1cccnc1C(=O)NCc1ccsc1.
What is the InChIKey of 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The InChIKey is ASMFPVFVYOHJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c12-9-2-1-4-13-10(9)11(15)14-6-8-3-5-16-7-8/h1-5,7H,6,12H2,(H,14,15).
What are the key properties of 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide has a molecular weight of 233.30 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 104742298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).