N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide

C15H13N5O — CID 110676539

IUPACN-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3cccnc3)n[nH]2)ccn1
InChIInChI=1S/C15H13N5O/c1-10-7-12(4-6-17-10)18-15(21)14-8-13(19-20-14)11-3-2-5-16-9-11/h2-9H,1H3,(H,19,20)(H,17,18,21)
InChIKeyJXUSHUHVSIYHAG-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.43
Rot. Bonds3

About N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide

N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide (PubChem CID 110676539) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
PubChem CID110676539
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC NameN-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3cccnc3)n[nH]2)ccn1
InChIInChI=1S/C15H13N5O/c1-10-7-12(4-6-17-10)18-15(21)14-8-13(19-20-14)11-3-2-5-16-9-11/h2-9H,1H3,(H,19,20)(H,17,18,21)
InChIKeyJXUSHUHVSIYHAG-UHFFFAOYSA-N
XLogP2.43
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-bromophenyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
CID 53087479
N-(4-carbamoylphenyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
CID 71828964
3-(4-methylphenyl)-N-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 19510252
N-(2-fluoro-4-methylphenyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
CID 53014348
N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide
CID 110691028
N-(3-methylphenyl)-3-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 53087403
N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]pyridine-3-carboxamide
CID 110732494
N-(2-methyl-4-pyridinyl)-5-oxo-1,2-dihydropyrazole-3-carboxamide
CID 112513900
3-(4-methoxyphenyl)-N-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 19508725
N-(4-acetamidophenyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 26273244
methyl 3-pyridin-3-yl-1H-pyrazole-5-carboximidate
CID 137027827
N-(2-chloro-4,6-dimethoxyphenyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
CID 53087480

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide (CID 110676539) is N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide is Cc1cc(NC(=O)c2cc(-c3cccnc3)n[nH]2)ccn1.
What is the InChIKey of N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide?
The InChIKey is JXUSHUHVSIYHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c1-10-7-12(4-6-17-10)18-15(21)14-8-13(19-20-14)11-3-2-5-16-9-11/h2-9H,1H3,(H,19,20)(H,17,18,21).
What are the key properties of N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide?
N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-pyridinyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 110676539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).