N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide

C19H25ClN4O — CID 24998043

IUPACN-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide
SMILESO=C(CCCCN1CCCCC1)Nc1cc(-c2ccc(Cl)cc2)[nH]n1
InChIInChI=1S/C19H25ClN4O/c20-16-9-7-15(8-10-16)17-14-18(23-22-17)21-19(25)6-2-5-13-24-11-3-1-4-12-24/h7-10,14H,1-6,11-13H2,(H2,21,22,23,25)
InChIKeyLOEWGPWXHKYVIM-UHFFFAOYSA-N
MW360.89 g/mol
LogP4.32
Rot. Bonds7

About N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide

N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide (PubChem CID 24998043) has the molecular formula C19H25ClN4O and a molecular weight of 360.89 g/mol. Its IUPAC name is N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide.

Molecular Properties

Compound NameN-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide
PubChem CID24998043
Molecular FormulaC19H25ClN4O
Molecular Weight360.89 g/mol
Exact Mass360.17
IUPAC NameN-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide
SMILESO=C(CCCCN1CCCCC1)Nc1cc(-c2ccc(Cl)cc2)[nH]n1
InChIInChI=1S/C19H25ClN4O/c20-16-9-7-15(8-10-16)17-14-18(23-22-17)21-19(25)6-2-5-13-24-11-3-1-4-12-24/h7-10,14H,1-6,11-13H2,(H2,21,22,23,25)
InChIKeyLOEWGPWXHKYVIM-UHFFFAOYSA-N
XLogP4.32
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.89
LogP ≤ 54.32
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-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide?
The IUPAC name of N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide (CID 24998043) is N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide.
What is the SMILES notation for N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide?
The canonical SMILES for N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide is O=C(CCCCN1CCCCC1)Nc1cc(-c2ccc(Cl)cc2)[nH]n1.
What is the InChIKey of N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide?
The InChIKey is LOEWGPWXHKYVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN4O/c20-16-9-7-15(8-10-16)17-14-18(23-22-17)21-19(25)6-2-5-13-24-11-3-1-4-12-24/h7-10,14H,1-6,11-13H2,(H2,21,22,23,25).
What are the key properties of N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide?
N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide has a molecular weight of 360.89 g/mol, XLogP of 4.32, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-5-piperidin-1-ylpentanamide is sourced from PubChem (CID 24998043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).