N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide

C15H14N4OS — CID 71797377

IUPACN-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide
SMILESCn1nc(CNC(=O)c2cccnc2)cc1-c1cccs1
InChIInChI=1S/C15H14N4OS/c1-19-13(14-5-3-7-21-14)8-12(18-19)10-17-15(20)11-4-2-6-16-9-11/h2-9H,10H2,1H3,(H,17,20)
InChIKeyPGASOBRSIQAFDD-UHFFFAOYSA-N
MW298.37 g/mol
LogP2.47
Rot. Bonds4

About N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide

N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide (PubChem CID 71797377) has the molecular formula C15H14N4OS and a molecular weight of 298.37 g/mol. Its IUPAC name is N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide
PubChem CID71797377
Molecular FormulaC15H14N4OS
Molecular Weight298.37 g/mol
Exact Mass298.09
IUPAC NameN-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide
SMILESCn1nc(CNC(=O)c2cccnc2)cc1-c1cccs1
InChIInChI=1S/C15H14N4OS/c1-19-13(14-5-3-7-21-14)8-12(18-19)10-17-15(20)11-4-2-6-16-9-11/h2-9H,10H2,1H3,(H,17,20)
InChIKeyPGASOBRSIQAFDD-UHFFFAOYSA-N
XLogP2.47
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-phenyl-N-(pyridin-3-yl)-3-(thiophen-2-yl)-1H-pyrazole-4-carboxamide
CID 2999058
3-(5-ME-2-Thienyl)-N'-(1-(4-pyridinyl)ethylidene)-1H-pyrazole-5-carbohydrazide
CID 5393006
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide
CID 2329736
Pyrazole scaffold, 7g
CID 25218482
N-benzyl-1-(2-cyanoethyl)-3-thiophen-2-ylpyrazole-4-carboxamide
CID 2529430
phenyl[3-(2-thienyl)-1H-pyrazol-1-yl]methanone
CID 2814851
3-methyl-1-(2-methylphenyl)-N-(pyridin-3-ylmethyl)thieno[2,3-c]pyrazole-5-carboxamide
CID 663824
(4-Phenylpiperazin-1-yl)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methanone
CID 2312348
N-(2-morpholin-4-ylethyl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide
CID 2327183
1-phenyl-N-(pyridin-4-yl)-3-(thiophen-2-yl)-1H-pyrazole-4-carboxamide
CID 5161671
[4-Fluoro-4-[[(5-methyl-2-pyridinyl)methylamino]methyl]piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone
CID 42606221
N-Benzyl-6-(thiophen-2-YL)pyridine-3-carboxamide
CID 54760394

Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide (CID 71797377) is N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide is Cn1nc(CNC(=O)c2cccnc2)cc1-c1cccs1.
What is the InChIKey of N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide?
The InChIKey is PGASOBRSIQAFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS/c1-19-13(14-5-3-7-21-14)8-12(18-19)10-17-15(20)11-4-2-6-16-9-11/h2-9H,10H2,1H3,(H,17,20).
What are the key properties of N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide?
N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-5-thiophen-2-ylpyrazol-3-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 71797377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).