N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide

C13H17N5O — CID 104640241

IUPACN-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2cnn(C)c2)nc1
InChIInChI=1S/C13H17N5O/c1-3-6-14-10-4-5-12(15-7-10)13(19)17-11-8-16-18(2)9-11/h4-5,7-9,14H,3,6H2,1-2H3,(H,17,19)
InChIKeyLSKYAIXKWRKNKY-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.89
Rot. Bonds5

About N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide

N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide (PubChem CID 104640241) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide
PubChem CID104640241
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC NameN-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2cnn(C)c2)nc1
InChIInChI=1S/C13H17N5O/c1-3-6-14-10-4-5-12(15-7-10)13(19)17-11-8-16-18(2)9-11/h4-5,7-9,14H,3,6H2,1-2H3,(H,17,19)
InChIKeyLSKYAIXKWRKNKY-UHFFFAOYSA-N
XLogP1.89
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methylpyrazol-4-yl)-6-(propylamino)pyridine-2-carboxamide
CID 62239806
6-[(1-methylpyrazol-4-yl)carbamoyl]pyridine-3-carboxylic acid
CID 43429931
5-(propylamino)-N-thiophen-3-ylpyridine-2-carboxamide
CID 104641679
N-(4-methylpiperazin-1-yl)-5-(propylamino)pyridine-2-carboxamide
CID 104641991
5-(butylamino)-N-(4-chlorophenyl)pyridine-2-carboxamide
CID 109180928
N-(3-fluorophenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179399
N-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 47028121
N-(4-methylphenyl)-5-(pentylamino)pyridine-2-carboxamide
CID 109195830
N-[2,6-di(propan-2-yl)phenyl]-5-(propylamino)pyridine-2-carboxamide
CID 109179407
N-[4-(4-methylpiperazin-1-yl)phenyl]-5-(pentylamino)pyridine-2-carboxamide
CID 109195891
N-(4-tert-butylphenyl)-5-(pentylamino)pyridine-2-carboxamide
CID 109195848
4-fluoro-N-(1-methylpyrazol-4-yl)benzamide
CID 60749610

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide (CID 104640241) is N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide is CCCNc1ccc(C(=O)Nc2cnn(C)c2)nc1.
What is the InChIKey of N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide?
The InChIKey is LSKYAIXKWRKNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-3-6-14-10-4-5-12(15-7-10)13(19)17-11-8-16-18(2)9-11/h4-5,7-9,14H,3,6H2,1-2H3,(H,17,19).
What are the key properties of N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide?
N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-4-yl)-5-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104640241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).