N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide

C21H26N2O2 — CID 71860677

IUPACN-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
SMILESCC1CC(NC(=O)C(O)c2ccccc2)CCN1Cc1ccccc1
InChIInChI=1S/C21H26N2O2/c1-16-14-19(12-13-23(16)15-17-8-4-2-5-9-17)22-21(25)20(24)18-10-6-3-7-11-18/h2-11,16,19-20,24H,12-15H2,1H3,(H,22,25)
InChIKeyAIDQRFFKPXLOHZ-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.89
Rot. Bonds5

About N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide

N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide (PubChem CID 71860677) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound NameN-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
PubChem CID71860677
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
SMILESCC1CC(NC(=O)C(O)c2ccccc2)CCN1Cc1ccccc1
InChIInChI=1S/C21H26N2O2/c1-16-14-19(12-13-23(16)15-17-8-4-2-5-9-17)22-21(25)20(24)18-10-6-3-7-11-18/h2-11,16,19-20,24H,12-15H2,1H3,(H,22,25)
InChIKeyAIDQRFFKPXLOHZ-UHFFFAOYSA-N
XLogP2.89
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[(2R,4S)-1-benzyl-2-methylpiperidin-4-yl]acetamide
CID 124692107
(2R)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
CID 118541642
N-(1-benzyl-2-methylpiperidin-4-yl)-2-cyanoacetamide
CID 165351593
N-(1-benzyl-2-methylpiperidin-4-yl)-3-bromoprop-2-ynamide
CID 131167223
1-amino-3-(1-benzyl-2-methylpiperidin-4-yl)thiourea
CID 130834689
3-(2-aminophenyl)-N-(1-benzyl-2-methylpiperidin-4-yl)propanamide;dihydrochloride
CID 120612982
(1-benzyl-2-methylpiperidin-4-yl)cyanamide
CID 130964411
1-(1-benzyl-2-methylpiperidin-4-yl)-3-[(1-hydroxycyclopentyl)methyl]urea
CID 111861088
N-(1-benzyl-2-methylpiperidin-4-yl)-2-cyclopent-2-en-1-ylacetamide
CID 166228361
N,1-dibenzyl-2-methylpiperidin-4-amine
CID 119029011
N-(1-benzyl-2-methylpiperidin-4-yl)-4-methyl-3-oxopiperazine-1-carboxamide
CID 122137724
1-(1-benzyl-2-methylpiperidin-4-yl)-3-(2-oxopiperidin-3-yl)urea
CID 71923796

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The IUPAC name of N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide (CID 71860677) is N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The canonical SMILES for N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide is CC1CC(NC(=O)C(O)c2ccccc2)CCN1Cc1ccccc1.
What is the InChIKey of N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
The InChIKey is AIDQRFFKPXLOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-16-14-19(12-13-23(16)15-17-8-4-2-5-9-17)22-21(25)20(24)18-10-6-3-7-11-18/h2-11,16,19-20,24H,12-15H2,1H3,(H,22,25).
What are the key properties of N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide?
N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide has a molecular weight of 338.45 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-methylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 71860677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).