N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride

C15H23Cl2N3O — CID 119918800

IUPACN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
SMILESCNC1CCCN(C(C)C(=O)Nc2cccc(Cl)c2)C1.Cl
InChIInChI=1S/C15H22ClN3O.ClH/c1-11(19-8-4-7-14(10-19)17-2)15(20)18-13-6-3-5-12(16)9-13;/h3,5-6,9,11,14,17H,4,7-8,10H2,1-2H3,(H,18,20);1H
InChIKeyNLNXNRGLFMUELR-UHFFFAOYSA-N
MW332.28 g/mol
LogP2.77
Rot. Bonds4

About N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride

N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride (PubChem CID 119918800) has the molecular formula C15H23Cl2N3O and a molecular weight of 332.28 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
PubChem CID119918800
Molecular FormulaC15H23Cl2N3O
Molecular Weight332.28 g/mol
Exact Mass331.12
IUPAC NameN-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
SMILESCNC1CCCN(C(C)C(=O)Nc2cccc(Cl)c2)C1.Cl
InChIInChI=1S/C15H22ClN3O.ClH/c1-11(19-8-4-7-14(10-19)17-2)15(20)18-13-6-3-5-12(16)9-13;/h3,5-6,9,11,14,17H,4,7-8,10H2,1-2H3,(H,18,20);1H
InChIKeyNLNXNRGLFMUELR-UHFFFAOYSA-N
XLogP2.77
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.28
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119918280
1-[1-(3-chloroanilino)-1-oxopropan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 17498457
2-[3-(methylamino)piperidin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide;hydrochloride
CID 119919119
N-(2,6-difluorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119918498
4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide
CID 119920088
N-(3-chlorophenyl)-2-(3,5-dimethylpiperidin-1-yl)propanamide
CID 18083488
(2R)-N-(3-chlorophenyl)-2-[(2S)-2-methylmorpholin-4-yl]propanamide
CID 51731055
2-[3-(methylamino)piperidin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 119918874
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545829
2-[3-(methylamino)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide;hydrochloride
CID 119918352
(2R)-N-(3-chlorophenyl)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propanamide
CID 98938107
N-(3-chlorophenyl)-2-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 86908959

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride?
The IUPAC name of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride (CID 119918800) is N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride.
What is the SMILES notation for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride?
The canonical SMILES for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride is CNC1CCCN(C(C)C(=O)Nc2cccc(Cl)c2)C1.Cl.
What is the InChIKey of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride?
The InChIKey is NLNXNRGLFMUELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O.ClH/c1-11(19-8-4-7-14(10-19)17-2)15(20)18-13-6-3-5-12(16)9-13;/h3,5-6,9,11,14,17H,4,7-8,10H2,1-2H3,(H,18,20);1H.
What are the key properties of N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride?
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride has a molecular weight of 332.28 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride is sourced from PubChem (CID 119918800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).