(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide

C22H34N2O2 — CID 70783649

IUPAC(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide
SMILESCN(CC1CCN(Cc2ccccc2)CC1)C(=O)[C@H](O)C1CCCCC1
InChIInChI=1S/C22H34N2O2/c1-23(22(26)21(25)20-10-6-3-7-11-20)16-19-12-14-24(15-13-19)17-18-8-4-2-5-9-18/h2,4-5,8-9,19-21,25H,3,6-7,10-17H2,1H3/t21-/m1/s1
InChIKeyZQDPIRXQQXEBDJ-OAQYLSRUSA-N
MW358.53 g/mol
LogP3.30
Rot. Bonds6

About (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide

(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide (PubChem CID 70783649) has the molecular formula C22H34N2O2 and a molecular weight of 358.53 g/mol. Its IUPAC name is (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound Name(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide
PubChem CID70783649
Molecular FormulaC22H34N2O2
Molecular Weight358.53 g/mol
Exact Mass358.26
IUPAC Name(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide
SMILESCN(CC1CCN(Cc2ccccc2)CC1)C(=O)[C@H](O)C1CCCCC1
InChIInChI=1S/C22H34N2O2/c1-23(22(26)21(25)20-10-6-3-7-11-20)16-19-12-14-24(15-13-19)17-18-8-4-2-5-9-18/h2,4-5,8-9,19-21,25H,3,6-7,10-17H2,1H3/t21-/m1/s1
InChIKeyZQDPIRXQQXEBDJ-OAQYLSRUSA-N
XLogP3.30
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.53
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide with MolForge

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Related Compounds

(2S)-2-amino-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-N-methylacetamide
CID 70738202
1-benzyl-N-[[1-(2-hydroxypropyl)piperidin-4-yl]methyl]-N-methylpiperidine-4-carboxamide
CID 136512341
propan-2-yl 2-(1-benzylpiperidin-4-yl)acetate
CID 83983157
(2S)-2-amino-N-[(1-benzylpiperidin-4-yl)methyl]-N-cyclopropyl-3-methylbutanamide
CID 66565350
N-[(1-benzylpiperidin-4-yl)methyl]-2-(1,1-dioxothiolan-3-yl)-N-methylacetamide
CID 70777786
2-[(1-benzylpiperidin-4-yl)methyl-methylamino]-1,3-oxazole-4-carboxylic acid
CID 134697080
1-amino-N-[(1-benzylpyrrolidin-3-yl)methyl]-N-methylcyclohexane-1-carboxamide;dihydrochloride
CID 119884983
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methylbenzamide
CID 10019926
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-methyl-2-phenylacetamide
CID 11163946
N-[(1-benzylpyrrolidin-3-yl)methyl]-2-cyclopentyl-2-hydroxy-N-methyl-2-phenylacetamide
CID 11697139
(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-N-methylmorpholine-2-carboxamide
CID 96579373
N-[(1-benzylpiperidin-4-yl)methyl]-1-ethyl-N-methyl-2-oxopyridine-4-carboxamide
CID 70716067

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide?
The IUPAC name of (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide (CID 70783649) is (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide.
What is the SMILES notation for (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide?
The canonical SMILES for (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide is CN(CC1CCN(Cc2ccccc2)CC1)C(=O)[C@H](O)C1CCCCC1.
What is the InChIKey of (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide?
The InChIKey is ZQDPIRXQQXEBDJ-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H34N2O2/c1-23(22(26)21(25)20-10-6-3-7-11-20)16-19-12-14-24(15-13-19)17-18-8-4-2-5-9-18/h2,4-5,8-9,19-21,25H,3,6-7,10-17H2,1H3/t21-/m1/s1.
What are the key properties of (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide?
(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide has a molecular weight of 358.53 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1-benzylpiperidin-4-yl)methyl]-2-cyclohexyl-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 70783649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).