4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide

C24H30N2O2 — CID 56702621

IUPAC4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide
SMILESO=C(CCC(=O)c1ccccc1)NC1CCCN(CCCc2ccccc2)C1
InChIInChI=1S/C24H30N2O2/c27-23(21-12-5-2-6-13-21)15-16-24(28)25-22-14-8-18-26(19-22)17-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13,22H,7-8,11,14-19H2,(H,25,28)
InChIKeyUPTHPXULDLMMGM-UHFFFAOYSA-N
MW378.52 g/mol
LogP3.86
Rot. Bonds9

About 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide

4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide (PubChem CID 56702621) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide.

Molecular Properties

Compound Name4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide
PubChem CID56702621
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC Name4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide
SMILESO=C(CCC(=O)c1ccccc1)NC1CCCN(CCCc2ccccc2)C1
InChIInChI=1S/C24H30N2O2/c27-23(21-12-5-2-6-13-21)15-16-24(28)25-22-14-8-18-26(19-22)17-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13,22H,7-8,11,14-19H2,(H,25,28)
InChIKeyUPTHPXULDLMMGM-UHFFFAOYSA-N
XLogP3.86
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 171328429
N-[1-(3-phenylpropyl)piperidin-3-yl]-3-pyrazol-1-ylpropanamide
CID 45198986
N-[1-(3-phenylpropyl)piperidin-3-yl]-3-thiophen-3-ylpropanamide
CID 45181504
2-(4-hydroxypiperidin-1-yl)-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 42191572
3-(2-oxoazepan-1-yl)-N-[1-(3-phenylpropyl)piperidin-3-yl]propanamide
CID 45224965
N-[(3R)-1-(3-phenylpropyl)piperidin-3-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 26397825
N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724
2-(cyclohexen-1-yl)-N-[(3S)-1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 42457135
3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 56853055
[(3R)-1-(3-phenylpropyl)pyrrolidin-3-yl]carbamic acid
CID 154457780
3-(4-oxoquinazolin-3-yl)-N-[1-(3-phenylpropyl)piperidin-3-yl]propanamide
CID 45184954
methyl 3-[[(3S)-1-(3-phenylpropyl)piperidin-3-yl]carbamoyl]benzoate
CID 25486979

Frequently Asked Questions

What is the IUPAC name of 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide?
The IUPAC name of 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide (CID 56702621) is 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide.
What is the SMILES notation for 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide?
The canonical SMILES for 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide is O=C(CCC(=O)c1ccccc1)NC1CCCN(CCCc2ccccc2)C1.
What is the InChIKey of 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide?
The InChIKey is UPTHPXULDLMMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c27-23(21-12-5-2-6-13-21)15-16-24(28)25-22-14-8-18-26(19-22)17-7-11-20-9-3-1-4-10-20/h1-6,9-10,12-13,22H,7-8,11,14-19H2,(H,25,28).
What are the key properties of 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide?
4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide has a molecular weight of 378.52 g/mol, XLogP of 3.86, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide is sourced from PubChem (CID 56702621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).