(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride

C18H21ClN2O2 — CID 119671696

IUPAC(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Oc2ccccc2)cc1)[C@H]1CCCCN1
InChIInChI=1S/C18H20N2O2.ClH/c21-18(17-8-4-5-13-19-17)20-14-9-11-16(12-10-14)22-15-6-2-1-3-7-15;/h1-3,6-7,9-12,17,19H,4-5,8,13H2,(H,20,21);1H/t17-;/m1./s1
InChIKeyWOTSRTXUUJJDSB-UNTBIKODSA-N
MW332.83 g/mol
LogP3.98
Rot. Bonds4

About (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride

(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride (PubChem CID 119671696) has the molecular formula C18H21ClN2O2 and a molecular weight of 332.83 g/mol. Its IUPAC name is (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride
PubChem CID119671696
Molecular FormulaC18H21ClN2O2
Molecular Weight332.83 g/mol
Exact Mass332.13
IUPAC Name(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Oc2ccccc2)cc1)[C@H]1CCCCN1
InChIInChI=1S/C18H20N2O2.ClH/c21-18(17-8-4-5-13-19-17)20-14-9-11-16(12-10-14)22-15-6-2-1-3-7-15;/h1-3,6-7,9-12,17,19H,4-5,8,13H2,(H,20,21);1H/t17-;/m1./s1
InChIKeyWOTSRTXUUJJDSB-UNTBIKODSA-N
XLogP3.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.83
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
N-[4-(4-methylsulfonylphenoxy)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119315410
N-(4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 56832268
2-[4-[[(2R)-piperidine-2-carbonyl]amino]phenoxy]acetic acid
CID 104913965
N-(2-phenoxyphenyl)piperidine-2-carboxamide
CID 18071902
N-(4-phenoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 75422319
N-(6-phenoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 119849166
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939
(2S)-N-(4-bromophenyl)piperidine-2-carboxamide;hydrochloride
CID 119670350
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide
CID 110462338
(2R)-6-oxo-N-(4-phenoxyphenyl)piperidine-2-carboxamide
CID 146122694
N-[4-(3-methylsulfonylphenoxy)phenyl]pyrrolidine-2-carboxamide
CID 119331523

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride (CID 119671696) is (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(Oc2ccccc2)cc1)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride?
The InChIKey is WOTSRTXUUJJDSB-UNTBIKODSA-N. The full InChI is InChI=1S/C18H20N2O2.ClH/c21-18(17-8-4-5-13-19-17)20-14-9-11-16(12-10-14)22-15-6-2-1-3-7-15;/h1-3,6-7,9-12,17,19H,4-5,8,13H2,(H,20,21);1H/t17-;/m1./s1.
What are the key properties of (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride?
(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride has a molecular weight of 332.83 g/mol, XLogP of 3.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119671696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).