N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide

C14H13N5O — CID 63819414

IUPACN-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide
SMILESCc1cc(NC(=O)c2cn[nH]c2-c2ccccc2)n[nH]1
InChIInChI=1S/C14H13N5O/c1-9-7-12(18-17-9)16-14(20)11-8-15-19-13(11)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,19)(H2,16,17,18,20)
InChIKeyMPMACFQMKMNONP-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.36
Rot. Bonds3

About N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide

N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide (PubChem CID 63819414) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide
PubChem CID63819414
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC NameN-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide
SMILESCc1cc(NC(=O)c2cn[nH]c2-c2ccccc2)n[nH]1
InChIInChI=1S/C14H13N5O/c1-9-7-12(18-17-9)16-14(20)11-8-15-19-13(11)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,19)(H2,16,17,18,20)
InChIKeyMPMACFQMKMNONP-UHFFFAOYSA-N
XLogP2.36
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide (CID 63819414) is N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide is Cc1cc(NC(=O)c2cn[nH]c2-c2ccccc2)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide?
The InChIKey is MPMACFQMKMNONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-9-7-12(18-17-9)16-14(20)11-8-15-19-13(11)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,19)(H2,16,17,18,20).
What are the key properties of N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide?
N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.36, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 63819414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).