1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide

C19H15N5O — CID 171981866

IUPAC1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide
SMILESO=C(Nc1cnn(-c2ccccc2)c1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H15N5O/c25-19(15-11-20-23(13-15)17-7-3-1-4-8-17)22-16-12-21-24(14-16)18-9-5-2-6-10-18/h1-14H,(H,22,25)
InChIKeyWLEZCUFNTCJAOR-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.31
Rot. Bonds4

About 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide

1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide (PubChem CID 171981866) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide
PubChem CID171981866
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC Name1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide
SMILESO=C(Nc1cnn(-c2ccccc2)c1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C19H15N5O/c25-19(15-11-20-23(13-15)17-7-3-1-4-8-17)22-16-12-21-24(14-16)18-9-5-2-6-10-18/h1-14H,(H,22,25)
InChIKeyWLEZCUFNTCJAOR-UHFFFAOYSA-N
XLogP3.31
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 110471191
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1-phenyl-N-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 25468256
N-[1-(3-chlorophenyl)pyrazol-4-yl]benzamide
CID 67287365
N-(2-aminophenyl)-1-phenylpyrazole-4-carboxamide
CID 28742301
N-(3-fluoro-4-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 9210715
N-(3-iodo-4-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 26285543
N-(1-phenylpyrazol-4-yl)-1H-pyrrole-2-carboxamide
CID 110470884
N-[4-(4-methylpiperazin-1-yl)phenyl]-1-phenylpyrazole-4-carboxamide
CID 134029541
5-bromo-N-(1-phenylpyrazol-4-yl)pyridine-2-carboxamide
CID 99816223
4-[(4-methylphenyl)sulfamoyl]-N-(1-phenylpyrazol-4-yl)benzamide
CID 47081142
6-methyl-N-(1-phenylpyrazol-4-yl)pyridine-2-carboxamide
CID 110472220

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide?
The IUPAC name of 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide (CID 171981866) is 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide is O=C(Nc1cnn(-c2ccccc2)c1)c1cnn(-c2ccccc2)c1.
What is the InChIKey of 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide?
The InChIKey is WLEZCUFNTCJAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c25-19(15-11-20-23(13-15)17-7-3-1-4-8-17)22-16-12-21-24(14-16)18-9-5-2-6-10-18/h1-14H,(H,22,25).
What are the key properties of 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide?
1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(1-phenylpyrazol-4-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 171981866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).