(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide

C20H24N2O — CID 26458131

IUPAC(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide
SMILESNC(=O)[C@H]1CCCN(CC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H24N2O/c21-20(23)18-12-7-13-22(14-18)15-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2,(H2,21,23)/t18-/m0/s1
InChIKeyJWKJGHUMYCDKBL-SFHVURJKSA-N
MW308.43 g/mol
LogP3.02
Rot. Bonds5

About (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide

(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide (PubChem CID 26458131) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide
PubChem CID26458131
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide
SMILESNC(=O)[C@H]1CCCN(CC(c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H24N2O/c21-20(23)18-12-7-13-22(14-18)15-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2,(H2,21,23)/t18-/m0/s1
InChIKeyJWKJGHUMYCDKBL-SFHVURJKSA-N
XLogP3.02
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1-(2,2-diphenylethyl)piperidine-3-carboxamide
CID 26458129
(3S)-1-(2-phenylethyl)piperidine-3-carboxamide
CID 782930
2-amino-3-(3-carbamoylpiperidin-1-yl)propanoic acid
CID 65443827
1-(2-amino-1-phenylethyl)piperidine-3-carboxamide
CID 55017302
2-[(3-carbamoylpiperidin-1-yl)methyl]benzoic acid
CID 43473268
1-[2-amino-2-(3-methoxyphenyl)ethyl]piperidine-3-carboxamide
CID 16788275
(3S)-1-(2,2-diphenylethyl)piperidine-3-carbaldehyde
CID 18665738
(3S)-1-[(2-chlorophenyl)methyl]piperidine-3-carboxamide
CID 6962119
1-[(2-methylsulfanylphenyl)methyl]piperidine-3-carboxamide
CID 66899395
1-[2-[(3-carbamoylpiperidin-1-yl)methyl]-3-oxobutyl]piperidine-3-carboxamide
CID 23456665
1-[(2-carbamothioylphenyl)methyl]piperidine-3-carboxamide
CID 24701330
1-[2-amino-2-(5-methylfuran-2-yl)ethyl]piperidine-3-carboxamide
CID 16794425

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide?
The IUPAC name of (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide (CID 26458131) is (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide.
What is the SMILES notation for (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide?
The canonical SMILES for (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide is NC(=O)[C@H]1CCCN(CC(c2ccccc2)c2ccccc2)C1.
What is the InChIKey of (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide?
The InChIKey is JWKJGHUMYCDKBL-SFHVURJKSA-N. The full InChI is InChI=1S/C20H24N2O/c21-20(23)18-12-7-13-22(14-18)15-19(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2,(H2,21,23)/t18-/m0/s1.
What are the key properties of (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide?
(3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(2,2-diphenylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 26458131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).