1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide

C19H17N3O — CID 134589164

IUPAC1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccn(-c2ccccc2)n1)C1(c2ccccc2)CC1
InChIInChI=1S/C19H17N3O/c23-18(19(12-13-19)15-7-3-1-4-8-15)20-17-11-14-22(21-17)16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,20,21,23)
InChIKeyWCTVWAJIFXAOEX-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.54
Rot. Bonds4

About 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide

1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide (PubChem CID 134589164) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
PubChem CID134589164
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccn(-c2ccccc2)n1)C1(c2ccccc2)CC1
InChIInChI=1S/C19H17N3O/c23-18(19(12-13-19)15-7-3-1-4-8-15)20-17-11-14-22(21-17)16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,20,21,23)
InChIKeyWCTVWAJIFXAOEX-UHFFFAOYSA-N
XLogP3.54
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Apinocaltamide
CID 118560618
19-(cyclopropylamino)-4,6,7,15-tetrahydro-5H-16,1-(azenometheno)-10,14-(metheno)pyrazolo[4,3-o][1,3,9]triazacyclohexadecin-8(9H)-one
CID 135566411
N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560409
2-[4-(3,3-difluorocyclobutyl)phenyl]-N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]acetamide
CID 118560709
5-(4-Fluorophenyl)-3-phenylacetylamino-4-(4-pyridyl)pyrazole
CID 15513074
Gsk-5498A
CID 46945384
5-(4-Fluorophenyl)-1-methyl-3-phenylacetylamino-4-(4-pyridyl)pyrazole
CID 69692723
2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide
CID 110472142
2-[4-(dimethylamino)phenyl]-N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]acetamide
CID 118560158
N-[1-[(4-cyano-3-fluorophenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560191
2-[4-(dimethylamino)phenyl]-N-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]acetamide
CID 118560322
N-[1-[(4-cyanophenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560356

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide (CID 134589164) is 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide is O=C(Nc1ccn(-c2ccccc2)n1)C1(c2ccccc2)CC1.
What is the InChIKey of 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide?
The InChIKey is WCTVWAJIFXAOEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-18(19(12-13-19)15-7-3-1-4-8-15)20-17-11-14-22(21-17)16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,20,21,23).
What are the key properties of 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide?
1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 134589164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).