N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide

C19H26N4O — CID 118735741

IUPACN-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide
SMILESO=C(CCCCN1CCCCC1)Nc1cc(-c2ccccc2)[nH]n1
InChIInChI=1S/C19H26N4O/c24-19(11-5-8-14-23-12-6-2-7-13-23)20-18-15-17(21-22-18)16-9-3-1-4-10-16/h1,3-4,9-10,15H,2,5-8,11-14H2,(H2,20,21,22,24)
InChIKeyRVSCCPPOAMFEOB-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.67
Rot. Bonds7

About N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide

N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide (PubChem CID 118735741) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide.

Molecular Properties

Compound NameN-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide
PubChem CID118735741
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide
SMILESO=C(CCCCN1CCCCC1)Nc1cc(-c2ccccc2)[nH]n1
InChIInChI=1S/C19H26N4O/c24-19(11-5-8-14-23-12-6-2-7-13-23)20-18-15-17(21-22-18)16-9-3-1-4-10-16/h1,3-4,9-10,15H,2,5-8,11-14H2,(H2,20,21,22,24)
InChIKeyRVSCCPPOAMFEOB-UHFFFAOYSA-N
XLogP3.67
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide?
The IUPAC name of N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide (CID 118735741) is N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide.
What is the SMILES notation for N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide?
The canonical SMILES for N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide is O=C(CCCCN1CCCCC1)Nc1cc(-c2ccccc2)[nH]n1.
What is the InChIKey of N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide?
The InChIKey is RVSCCPPOAMFEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c24-19(11-5-8-14-23-12-6-2-7-13-23)20-18-15-17(21-22-18)16-9-3-1-4-10-16/h1,3-4,9-10,15H,2,5-8,11-14H2,(H2,20,21,22,24).
What are the key properties of N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide?
N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide has a molecular weight of 326.44 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-phenyl-1H-pyrazol-3-yl)-5-piperidin-1-ylpentanamide is sourced from PubChem (CID 118735741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).