N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide

C21H26N2O2 — CID 51167538

IUPACN-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)NC(c1ccccc1)c1ccccc1)N1CCC(O)CC1
InChIInChI=1S/C21H26N2O2/c1-16(23-14-12-19(24)13-15-23)21(25)22-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,19-20,24H,12-15H2,1H3,(H,22,25)
InChIKeyCIIQQUDNCALSNZ-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.74
Rot. Bonds5

About N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide

N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide (PubChem CID 51167538) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide
PubChem CID51167538
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)NC(c1ccccc1)c1ccccc1)N1CCC(O)CC1
InChIInChI=1S/C21H26N2O2/c1-16(23-14-12-19(24)13-15-23)21(25)22-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,19-20,24H,12-15H2,1H3,(H,22,25)
InChIKeyCIIQQUDNCALSNZ-UHFFFAOYSA-N
XLogP2.74
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 ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-benzhydryl-2-(4-methylpiperazin-1-yl)propanamide
CID 1439178
2-[4-(acetamidomethyl)piperidin-1-yl]-N-benzhydrylpropanamide
CID 55841833
N-benzhydryl-2-[3-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 111543768
N-cyclopropyl-2-[4-[1-oxo-1-(1-phenylethylamino)propan-2-yl]piperazin-1-yl]propanamide
CID 46697935
2-(4-hydroxypiperidin-1-yl)-N-pentan-3-ylpropanamide
CID 60719341
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(1-phenylethyl)propanamide
CID 75810047
(2S)-N-benzhydryl-2-[4-[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]propanamide
CID 30625205
(2R)-N-benzhydryl-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]propanamide
CID 41119753
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-phenylpropanamide
CID 78962370
(2R)-N-benzhydryl-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]propanamide
CID 11944117
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-benzhydrylpropanamide
CID 120772324
ethane;1-(4-hydroxypiperidin-1-yl)-1-phenylpropan-2-one
CID 143630259

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide?
The IUPAC name of N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide (CID 51167538) is N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide.
What is the SMILES notation for N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide?
The canonical SMILES for N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide is CC(C(=O)NC(c1ccccc1)c1ccccc1)N1CCC(O)CC1.
What is the InChIKey of N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide?
The InChIKey is CIIQQUDNCALSNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-16(23-14-12-19(24)13-15-23)21(25)22-20(17-8-4-2-5-9-17)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-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide?
N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide has a molecular weight of 338.45 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide is sourced from PubChem (CID 51167538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).