N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride

C15H23ClN2O2 — CID 119317160

IUPACN-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC(O)Cc1ccccc1)C1CCCNC1
InChIInChI=1S/C15H22N2O2.ClH/c18-14(9-12-5-2-1-3-6-12)11-17-15(19)13-7-4-8-16-10-13;/h1-3,5-6,13-14,16,18H,4,7-11H2,(H,17,19);1H
InChIKeyLMOMBAPXVCHEED-UHFFFAOYSA-N
MW298.81 g/mol
LogP1.13
Rot. Bonds5

About N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride

N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride (PubChem CID 119317160) has the molecular formula C15H23ClN2O2 and a molecular weight of 298.81 g/mol. Its IUPAC name is N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride
PubChem CID119317160
Molecular FormulaC15H23ClN2O2
Molecular Weight298.81 g/mol
Exact Mass298.14
IUPAC NameN-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC(O)Cc1ccccc1)C1CCCNC1
InChIInChI=1S/C15H22N2O2.ClH/c18-14(9-12-5-2-1-3-6-12)11-17-15(19)13-7-4-8-16-10-13;/h1-3,5-6,13-14,16,18H,4,7-11H2,(H,17,19);1H
InChIKeyLMOMBAPXVCHEED-UHFFFAOYSA-N
XLogP1.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.81
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-3-phenyl-2-[[(3S)-piperidine-3-carbonyl]amino]propanoic acid
CID 104902032
(3S)-N-(1-hydroxy-3-phenylpropan-2-yl)piperidine-3-carboxamide
CID 81141325
(3R)-N-(1-hydroxy-3-phenylpropan-2-yl)piperidine-3-carboxamide
CID 81141485
(3S)-N-[(2S)-2-(2-chlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
CID 124589589
4-[(2-hydroxy-3-phenylpropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673460
N-[2-(2,6-dichlorophenyl)-2-hydroxyethyl]piperidine-3-carboxamide
CID 154759784
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
benzyl (2S)-2-acetamido-3-[[(3R)-piperidine-3-carbonyl]amino]propanoate;hydrochloride
CID 86588489
N-(3-methyl-2-phenylbutyl)piperidine-3-carboxamide
CID 119294119
N-(4-hydroxy-2-phenylbutyl)piperidine-3-carboxamide
CID 119326534
2-hydroxy-3-[[(3R)-piperidine-3-carbonyl]amino]propanoic acid
CID 81134818
N-[1-(benzylamino)-1-oxopropan-2-yl]piperidine-3-carboxamide;hydrochloride
CID 119304562

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride (CID 119317160) is N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride is Cl.O=C(NCC(O)Cc1ccccc1)C1CCCNC1.
What is the InChIKey of N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride?
The InChIKey is LMOMBAPXVCHEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2.ClH/c18-14(9-12-5-2-1-3-6-12)11-17-15(19)13-7-4-8-16-10-13;/h1-3,5-6,13-14,16,18H,4,7-11H2,(H,17,19);1H.
What are the key properties of N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride?
N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride has a molecular weight of 298.81 g/mol, XLogP of 1.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-phenylpropyl)piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119317160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).