4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide

C22H24N4O2 — CID 59486701

IUPAC4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide
SMILESCN(O)C(=O)N1CCC(c2cc(-c3ccccc3)n(-c3ccccc3)n2)CC1
InChIInChI=1S/C22H24N4O2/c1-24(28)22(27)25-14-12-17(13-15-25)20-16-21(18-8-4-2-5-9-18)26(23-20)19-10-6-3-7-11-19/h2-11,16-17,28H,12-15H2,1H3
InChIKeyNBFZAJBRGMBKTA-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.16
Rot. Bonds3

About 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide

4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide (PubChem CID 59486701) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide
PubChem CID59486701
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide
SMILESCN(O)C(=O)N1CCC(c2cc(-c3ccccc3)n(-c3ccccc3)n2)CC1
InChIInChI=1S/C22H24N4O2/c1-24(28)22(27)25-14-12-17(13-15-25)20-16-21(18-8-4-2-5-9-18)26(23-20)19-10-6-3-7-11-19/h2-11,16-17,28H,12-15H2,1H3
InChIKeyNBFZAJBRGMBKTA-UHFFFAOYSA-N
XLogP4.16
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide?
The IUPAC name of 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide (CID 59486701) is 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide?
The canonical SMILES for 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide is CN(O)C(=O)N1CCC(c2cc(-c3ccccc3)n(-c3ccccc3)n2)CC1.
What is the InChIKey of 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide?
The InChIKey is NBFZAJBRGMBKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-24(28)22(27)25-14-12-17(13-15-25)20-16-21(18-8-4-2-5-9-18)26(23-20)19-10-6-3-7-11-19/h2-11,16-17,28H,12-15H2,1H3.
What are the key properties of 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide?
4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,5-diphenylpyrazol-3-yl)-N-hydroxy-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 59486701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).