1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide

C21H24N2O2 — CID 888289

IUPAC1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H24N2O2/c22-21(25)18-11-13-23(14-12-18)20(24)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,22,25)
InChIKeyXUDGXVIFCGMYAZ-UHFFFAOYSA-N
MW336.44 g/mol
LogP2.93
Rot. Bonds5

About 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide

1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide (PubChem CID 888289) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide
PubChem CID888289
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H24N2O2/c22-21(25)18-11-13-23(14-12-18)20(24)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,22,25)
InChIKeyXUDGXVIFCGMYAZ-UHFFFAOYSA-N
XLogP2.93
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide (CID 888289) is 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)CC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide?
The InChIKey is XUDGXVIFCGMYAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c22-21(25)18-11-13-23(14-12-18)20(24)15-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,18-19H,11-15H2,(H2,22,25).
What are the key properties of 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide?
1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-diphenylpropanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 888289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).