N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide

C22H26N2O2 — CID 94035900

IUPACN-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c1-17(23-21(25)20-10-6-3-7-11-20)22(26)24-14-12-19(13-15-24)16-18-8-4-2-5-9-18/h2-11,17,19H,12-16H2,1H3,(H,23,25)/t17-/m1/s1
InChIKeyMHLDUCUADOZEEA-QGZVFWFLSA-N
MW350.46 g/mol
LogP3.29
Rot. Bonds5

About N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide

N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide (PubChem CID 94035900) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound NameN-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide
PubChem CID94035900
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C22H26N2O2/c1-17(23-21(25)20-10-6-3-7-11-20)22(26)24-14-12-19(13-15-24)16-18-8-4-2-5-9-18/h2-11,17,19H,12-16H2,1H3,(H,23,25)/t17-/m1/s1
InChIKeyMHLDUCUADOZEEA-QGZVFWFLSA-N
XLogP3.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]acetamide
CID 78780530
N-[(2S)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]-2-ethylbutanamide
CID 110348046
ethyl N-[(2S)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]carbamate
CID 110348071
N-[1-[3-(hydroxymethyl)pyrrolidin-1-yl]-1-oxopropan-2-yl]benzamide
CID 62370951
3-[(2S)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]-1,1-diethylurea
CID 110348074
N-[1-[(3R)-3-hydroxypyrrolidin-1-yl]-1-oxopropan-2-yl]benzamide
CID 66291291
1-(4-benzylpiperidin-1-yl)-2-methyl-3-(methylamino)propan-1-one
CID 79196158
N-[1-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]-1-oxopropan-2-yl]benzamide
CID 55590117
2-amino-1-(4-benzylpiperidin-1-yl)-3-methylbutan-1-one;hydrochloride
CID 119262390
(4-benzylpiperidin-1-yl)-phenylmethanone
CID 796596
(2R)-1-(4-benzylpiperidin-1-yl)-2-phenylsulfanylpropan-1-one
CID 2575053
3-(4-benzylpiperidin-1-yl)-3-oxo-N-propan-2-ylpropanamide
CID 108940852

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide?
The IUPAC name of N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide (CID 94035900) is N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide?
The canonical SMILES for N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide is C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide?
The InChIKey is MHLDUCUADOZEEA-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-17(23-21(25)20-10-6-3-7-11-20)22(26)24-14-12-19(13-15-24)16-18-8-4-2-5-9-18/h2-11,17,19H,12-16H2,1H3,(H,23,25)/t17-/m1/s1.
What are the key properties of N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide?
N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 94035900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).