N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride

C13H19Cl2N3O — CID 165430478

IUPACN-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride
SMILESCNC1CCN(C(=O)Nc2ccc(Cl)cc2)CC1.Cl
InChIInChI=1S/C13H18ClN3O.ClH/c1-15-11-6-8-17(9-7-11)13(18)16-12-4-2-10(14)3-5-12;/h2-5,11,15H,6-9H2,1H3,(H,16,18);1H
InChIKeyQDTWLCDOAKWTNL-UHFFFAOYSA-N
MW304.22 g/mol
LogP2.98
Rot. Bonds2

About N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride

N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride (PubChem CID 165430478) has the molecular formula C13H19Cl2N3O and a molecular weight of 304.22 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride
PubChem CID165430478
Molecular FormulaC13H19Cl2N3O
Molecular Weight304.22 g/mol
Exact Mass303.09
IUPAC NameN-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride
SMILESCNC1CCN(C(=O)Nc2ccc(Cl)cc2)CC1.Cl
InChIInChI=1S/C13H18ClN3O.ClH/c1-15-11-6-8-17(9-7-11)13(18)16-12-4-2-10(14)3-5-12;/h2-5,11,15H,6-9H2,1H3,(H,16,18);1H
InChIKeyQDTWLCDOAKWTNL-UHFFFAOYSA-N
XLogP2.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.22
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride
CID 165430484
N-(4-chlorophenyl)-4-cyanopiperidine-1-carboxamide
CID 60969957
(4-chlorophenyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 83728657
N-(4-chlorophenyl)-4-(4-methylbenzoyl)piperidine-1-carboxamide
CID 55874085
2-(4-chlorophenyl)-1-[4-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119563636
N-(4-chlorophenyl)-3-(diethylamino)pyrrolidine-1-carboxamide
CID 110446851
N-(4-chlorophenyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 81493727
N-(4-chlorophenyl)-4-(4-methoxypiperidin-1-yl)piperidine-1-carboxamide
CID 90616556
(3R,4S)-N-(4-chlorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79411419
4-[[2-(4-chlorobenzoyl)benzoyl]amino]-N-phenylpiperidine-1-carboxamide
CID 46530497
1-(1-acetylpyrrolidin-3-yl)-3-(4-chlorophenyl)urea
CID 110874676
N-(4-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 110884355

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride?
The IUPAC name of N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride (CID 165430478) is N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride?
The canonical SMILES for N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride is CNC1CCN(C(=O)Nc2ccc(Cl)cc2)CC1.Cl.
What is the InChIKey of N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride?
The InChIKey is QDTWLCDOAKWTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O.ClH/c1-15-11-6-8-17(9-7-11)13(18)16-12-4-2-10(14)3-5-12;/h2-5,11,15H,6-9H2,1H3,(H,16,18);1H.
What are the key properties of N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride?
N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride has a molecular weight of 304.22 g/mol, XLogP of 2.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride is sourced from PubChem (CID 165430478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).