N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride

C19H22ClN3O2 — CID 119307803

IUPACN-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1)c1ccc(NC(=O)C2CCCNC2)cc1
InChIInChI=1S/C19H21N3O2.ClH/c23-18(21-16-6-2-1-3-7-16)14-8-10-17(11-9-14)22-19(24)15-5-4-12-20-13-15;/h1-3,6-11,15,20H,4-5,12-13H2,(H,21,23)(H,22,24);1H
InChIKeyCPWOPMYCAQXCNX-UHFFFAOYSA-N
MW359.86 g/mol
LogP3.30
Rot. Bonds4

About N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride

N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride (PubChem CID 119307803) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
PubChem CID119307803
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC NameN-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccccc1)c1ccc(NC(=O)C2CCCNC2)cc1
InChIInChI=1S/C19H21N3O2.ClH/c23-18(21-16-6-2-1-3-7-16)14-8-10-17(11-9-14)22-19(24)15-5-4-12-20-13-15;/h1-3,6-11,15,20H,4-5,12-13H2,(H,21,23)(H,22,24);1H
InChIKeyCPWOPMYCAQXCNX-UHFFFAOYSA-N
XLogP3.30
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 53.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-benzamidophenyl)piperidine-3-carboxamide;hydrochloride
CID 119282577
N-[4-(2-phenylethylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 119303511
N-[4-(propan-2-ylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 60927369
N-[4-(propylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119297921
N-(3-benzoylphenyl)piperidine-3-carboxamide
CID 119279700
(3R)-N-[4-(dimethylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 81123557
N-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]piperidine-3-carboxamide;dihydrochloride
CID 119885582
N-[[4-[(4-fluorobenzoyl)amino]phenyl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119311250
propan-2-yl 4-(piperidine-3-carbonylamino)benzoate
CID 43702839
N-[4-(1-phenylethylamino)phenyl]piperidine-3-carboxamide
CID 119300277
N-[1-[4-(phenylcarbamoylamino)phenyl]ethyl]piperidine-3-carboxamide;hydrochloride
CID 119288571
N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 119713611

Frequently Asked Questions

What is the IUPAC name of N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride (CID 119307803) is N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride is Cl.O=C(Nc1ccccc1)c1ccc(NC(=O)C2CCCNC2)cc1.
What is the InChIKey of N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride?
The InChIKey is CPWOPMYCAQXCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2.ClH/c23-18(21-16-6-2-1-3-7-16)14-8-10-17(11-9-14)22-19(24)15-5-4-12-20-13-15;/h1-3,6-11,15,20H,4-5,12-13H2,(H,21,23)(H,22,24);1H.
What are the key properties of N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride?
N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride has a molecular weight of 359.86 g/mol, XLogP of 3.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119307803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).