N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide

C23H24N4O2 — CID 34424786

IUPACN-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
SMILESCc1c(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)cnn1-c1ccccc1
InChIInChI=1S/C23H24N4O2/c1-17-21(16-24-27(17)20-10-6-3-7-11-20)23(29)26-14-12-19(13-15-26)25-22(28)18-8-4-2-5-9-18/h2-11,16,19H,12-15H2,1H3,(H,25,28)
InChIKeyMKWZTIJWWTWWFY-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.22
Rot. Bonds4

About N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide

N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide (PubChem CID 34424786) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
PubChem CID34424786
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC NameN-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
SMILESCc1c(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)cnn1-c1ccccc1
InChIInChI=1S/C23H24N4O2/c1-17-21(16-24-27(17)20-10-6-3-7-11-20)23(29)26-14-12-19(13-15-26)25-22(28)18-8-4-2-5-9-18/h2-11,16,19H,12-15H2,1H3,(H,25,28)
InChIKeyMKWZTIJWWTWWFY-UHFFFAOYSA-N
XLogP3.22
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[1-(4-chlorophenyl)-5-propan-2-ylpyrazole-4-carbonyl]piperidin-4-yl]benzamide
CID 46576774
[(3R)-3-aminopyrrolidin-1-yl]-(5-methyl-1-phenylpyrazol-4-yl)methanone
CID 119412099
N-[1-(1-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidin-4-yl]benzamide
CID 38140397
(5-methyl-1-phenylpyrazol-4-yl)-[(7R)-7-phenyl-1,4-thiazepan-4-yl]methanone
CID 99903755
N-[1-[1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carbonyl]piperidin-4-yl]benzamide
CID 18268324
(3-methoxypyrrolidin-1-yl)-(5-methyl-1-phenylpyrazol-4-yl)methanone
CID 108730568
[3-(benzenesulfonyl)pyrrolidin-1-yl]-(5-methyl-1-phenylpyrazol-4-yl)methanone
CID 90586770
N-hydroxy-2-(5-methyl-1-phenylpyrazole-4-carbonyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-7-carboxamide
CID 58465642
(4-amino-3,3-dimethylpiperidin-1-yl)-(5-methyl-1-phenylpyrazol-4-yl)methanone
CID 120816830
(5-methyl-1-phenylpyrazol-4-yl)-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone
CID 90495061
2-methyl-5-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]-4-phenyl-1,2,4-triazol-3-one
CID 90540357
5-methyl-1-phenyl-N-piperidin-3-ylpyrazole-4-carboxamide
CID 119427580

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide?
The IUPAC name of N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide (CID 34424786) is N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide is Cc1c(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)cnn1-c1ccccc1.
What is the InChIKey of N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide?
The InChIKey is MKWZTIJWWTWWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-17-21(16-24-27(17)20-10-6-3-7-11-20)23(29)26-14-12-19(13-15-26)25-22(28)18-8-4-2-5-9-18/h2-11,16,19H,12-15H2,1H3,(H,25,28).
What are the key properties of N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide?
N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 34424786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).