N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide

C21H26N2O2 — CID 111113013

IUPACN-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)Nc2ccccc2Cc2ccccc2)CC1
InChIInChI=1S/C21H26N2O2/c1-16(24)18-11-13-23(14-12-18)21(25)22-20-10-6-5-9-19(20)15-17-7-3-2-4-8-17/h2-10,16,18,24H,11-15H2,1H3,(H,22,25)
InChIKeyPRAWKLHIOHWEFG-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.90
Rot. Bonds4

About N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide

N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide (PubChem CID 111113013) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
PubChem CID111113013
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)Nc2ccccc2Cc2ccccc2)CC1
InChIInChI=1S/C21H26N2O2/c1-16(24)18-11-13-23(14-12-18)21(25)22-20-10-6-5-9-19(20)15-17-7-3-2-4-8-17/h2-10,16,18,24H,11-15H2,1H3,(H,22,25)
InChIKeyPRAWKLHIOHWEFG-UHFFFAOYSA-N
XLogP3.90
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4aS,8aR)-N-(2-benzylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 95284375
N-[2-(cyclopropylmethoxy)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111453726
1-(2-benzylphenyl)-3-butan-2-ylurea
CID 75833712
N-[2-(difluoromethoxy)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111424799
(3S)-N-(2-benzylphenyl)-3-(methoxymethyl)piperidine-1-carboxamide
CID 96541051
N-(2-benzylphenyl)-4-[(2R)-oxolane-2-carbonyl]piperazine-1-carboxamide
CID 51944792
N-[3-(aminomethyl)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 106836739
(2S)-N-(2-benzylphenyl)-2-pyrrolidin-1-ylpropanamide
CID 32728580
2-[1-[(2-ethylphenyl)carbamoyl]azetidin-3-yl]propanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide (CID 111113013) is N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide is CC(O)C1CCN(C(=O)Nc2ccccc2Cc2ccccc2)CC1.
What is the InChIKey of N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The InChIKey is PRAWKLHIOHWEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-16(24)18-11-13-23(14-12-18)21(25)22-20-10-6-5-9-19(20)15-17-7-3-2-4-8-17/h2-10,16,18,24H,11-15H2,1H3,(H,22,25).
What are the key properties of N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide has a molecular weight of 338.45 g/mol, XLogP of 3.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 111113013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).