4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide

C16H24N4O — CID 70118904

IUPAC4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide
SMILESO=C(NN1CCNCC1)C1(c2ccccc2)CCNCC1
InChIInChI=1S/C16H24N4O/c21-15(19-20-12-10-18-11-13-20)16(6-8-17-9-7-16)14-4-2-1-3-5-14/h1-5,17-18H,6-13H2,(H,19,21)
InChIKeyPZCYIBXBTWVINZ-UHFFFAOYSA-N
MW288.39 g/mol
LogP0.24
Rot. Bonds3

About 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide

4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide (PubChem CID 70118904) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide
PubChem CID70118904
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide
SMILESO=C(NN1CCNCC1)C1(c2ccccc2)CCNCC1
InChIInChI=1S/C16H24N4O/c21-15(19-20-12-10-18-11-13-20)16(6-8-17-9-7-16)14-4-2-1-3-5-14/h1-5,17-18H,6-13H2,(H,19,21)
InChIKeyPZCYIBXBTWVINZ-UHFFFAOYSA-N
XLogP0.24
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(1-phenylcyclobutyl)-piperazin-1-ylmethanone
CID 110463899
N-ethylsulfonyl-4-phenylpiperidine-4-carboxamide
CID 103307088
ethyl 1-[(4-phenylpiperidine-4-carbonyl)amino]piperidine-3-carboxylate
CID 139912462
[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]-(4-phenylpiperidin-4-yl)methanone
CID 107220719
1-azabicyclo[2.2.2]octane;4-phenylpiperidine-4-carboxylic acid
CID 145196382
1-phenyl-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide
CID 119448297
N-(2-hydroxy-2-methylpropyl)-4-phenylpiperidine-4-carboxamide
CID 65106988
(2R)-3-hydroxy-2-[(4-phenylpiperidine-4-carbonyl)amino]propanoic acid
CID 80756050
N-(3,3-dimethylbutyl)-4-phenylpiperidine-4-carboxamide
CID 115597355
(1-methyl-4-phenylpiperidin-4-yl)-piperazin-1-ylmethanone
CID 59716936
1-phenyl-N-(3-piperazin-1-ylpropyl)cyclopentane-1-carboxamide
CID 119393727
(2-methylthiomorpholin-4-yl)-(4-phenylpiperidin-4-yl)methanone
CID 115734108

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide?
The IUPAC name of 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide (CID 70118904) is 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide?
The canonical SMILES for 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide is O=C(NN1CCNCC1)C1(c2ccccc2)CCNCC1.
What is the InChIKey of 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide?
The InChIKey is PZCYIBXBTWVINZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c21-15(19-20-12-10-18-11-13-20)16(6-8-17-9-7-16)14-4-2-1-3-5-14/h1-5,17-18H,6-13H2,(H,19,21).
What are the key properties of 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide?
4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 0.24, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-piperazin-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 70118904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).