4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide

C10H9ClN4O — CID 81226455

IUPAC4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCn1nccc1NC(=O)c1cnccc1Cl
InChIInChI=1S/C10H9ClN4O/c1-15-9(3-5-13-15)14-10(16)7-6-12-4-2-8(7)11/h2-6H,1H3,(H,14,16)
InChIKeyNFKIIUPZJXUXHT-UHFFFAOYSA-N
MW236.66 g/mol
LogP1.72
Rot. Bonds2

About 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide

4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 81226455) has the molecular formula C10H9ClN4O and a molecular weight of 236.66 g/mol. Its IUPAC name is 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
PubChem CID81226455
Molecular FormulaC10H9ClN4O
Molecular Weight236.66 g/mol
Exact Mass236.05
IUPAC Name4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCn1nccc1NC(=O)c1cnccc1Cl
InChIInChI=1S/C10H9ClN4O/c1-15-9(3-5-13-15)14-10(16)7-6-12-4-2-8(7)11/h2-6H,1H3,(H,14,16)
InChIKeyNFKIIUPZJXUXHT-UHFFFAOYSA-N
XLogP1.72
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.66
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 81443340
N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
3-(3-hydroxyprop-1-ynyl)-N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 66482472
5-chloro-N-(2-methylpyrazol-3-yl)pyrazine-2-carboxamide
CID 107257615
5-chloro-2-(methylamino)-N-(2-methylpyrazol-3-yl)benzamide
CID 62173538
3-(3-aminoprop-1-ynyl)-N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 66484078
2-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 66675219
4-bromo-3-chloro-N-(2-methylpyrazol-3-yl)benzamide
CID 81005079
6-amino-3-chloro-N-(2-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 55041524
4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234
2-chloro-N-(2-methylpyrazol-3-yl)-3-nitrobenzamide
CID 112576364
1-(2,6-dichlorophenyl)-3-(2-methylpyrazol-3-yl)urea
CID 108813825

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide (CID 81226455) is 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide is Cn1nccc1NC(=O)c1cnccc1Cl.
What is the InChIKey of 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is NFKIIUPZJXUXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN4O/c1-15-9(3-5-13-15)14-10(16)7-6-12-4-2-8(7)11/h2-6H,1H3,(H,14,16).
What are the key properties of 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 236.66 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 81226455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).