N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide

C23H24N4O2 — CID 20953788

IUPACN-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnn(-c3ccccc3)c2C2CCNCC2)cc1
InChIInChI=1S/C23H24N4O2/c1-16(28)17-7-9-19(10-8-17)26-23(29)21-15-25-27(20-5-3-2-4-6-20)22(21)18-11-13-24-14-12-18/h2-10,15,18,24H,11-14H2,1H3,(H,26,29)
InChIKeyFYPZTHNKECBKET-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.79
Rot. Bonds5

About N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide

N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide (PubChem CID 20953788) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
PubChem CID20953788
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnn(-c3ccccc3)c2C2CCNCC2)cc1
InChIInChI=1S/C23H24N4O2/c1-16(28)17-7-9-19(10-8-17)26-23(29)21-15-25-27(20-5-3-2-4-6-20)22(21)18-11-13-24-14-12-18/h2-10,15,18,24H,11-14H2,1H3,(H,26,29)
InChIKeyFYPZTHNKECBKET-UHFFFAOYSA-N
XLogP3.79
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,1-bis(4-fluorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20867242
N-(4-bromo-3-methylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20854859
1-(3-methylphenyl)-N-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146053191
N,1-bis(4-methoxyphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20953785
N-(4-acetamidophenyl)-1-(3-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146059794
N-(2-fluorophenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20953791
N-(2-methoxyphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20866625
N-(2,3-dimethylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146053304
N-(4-methoxyphenyl)-1-(4-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20953848
N-(4-chlorophenyl)-1-(3-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146053171
N-(4-bromophenyl)-1-(4-chlorophenyl)-5-piperidin-4-ylpyrazole-4-carboxamide
CID 20924035
N-(4-ethylphenyl)-1-(3-methylphenyl)-5-piperidin-4-ylpyrazole-4-carboxamide;hydrochloride
CID 146053168

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide (CID 20953788) is N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide is CC(=O)c1ccc(NC(=O)c2cnn(-c3ccccc3)c2C2CCNCC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide?
The InChIKey is FYPZTHNKECBKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-16(28)17-7-9-19(10-8-17)26-23(29)21-15-25-27(20-5-3-2-4-6-20)22(21)18-11-13-24-14-12-18/h2-10,15,18,24H,11-14H2,1H3,(H,26,29).
What are the key properties of N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide?
N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-1-phenyl-5-piperidin-4-ylpyrazole-4-carboxamide is sourced from PubChem (CID 20953788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).