N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine

C17H18Cl2N2 — CID 106820276

IUPACN-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine
SMILESClc1ccc(NC2CCN(c3ccccc3)CC2)c(Cl)c1
InChIInChI=1S/C17H18Cl2N2/c18-13-6-7-17(16(19)12-13)20-14-8-10-21(11-9-14)15-4-2-1-3-5-15/h1-7,12,14,20H,8-11H2
InChIKeyFEUYAZXOEAMMMO-UHFFFAOYSA-N
MW321.25 g/mol
LogP5.07
Rot. Bonds3

About N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine

N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine (PubChem CID 106820276) has the molecular formula C17H18Cl2N2 and a molecular weight of 321.25 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine
PubChem CID106820276
Molecular FormulaC17H18Cl2N2
Molecular Weight321.25 g/mol
Exact Mass320.08
IUPAC NameN-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine
SMILESClc1ccc(NC2CCN(c3ccccc3)CC2)c(Cl)c1
InChIInChI=1S/C17H18Cl2N2/c18-13-6-7-17(16(19)12-13)20-14-8-10-21(11-9-14)15-4-2-1-3-5-15/h1-7,12,14,20H,8-11H2
InChIKeyFEUYAZXOEAMMMO-UHFFFAOYSA-N
XLogP5.07
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.25
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-1-phenylpiperidin-4-amine
CID 106820286
N-(2,5-dichlorophenyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166964
N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine
CID 103892780
N-(2,4-dichlorophenyl)-3-(4-phenylpiperazin-1-yl)propanamide
CID 109027205
2,4-dichloro-N-(3-methylcyclopentyl)aniline
CID 64502454
N-cyclobutyl-1-phenylpiperidin-4-amine
CID 103901830
1-phenyl-N-(2,4,5-trichlorophenyl)piperidine-4-carboxamide
CID 17152279
N-(2-fluorophenyl)-1-pyridin-4-ylpiperidin-4-amine
CID 43166973
5-chloro-2-[4-(2-fluoroanilino)piperidin-1-yl]benzonitrile
CID 133330842
2-N-(1-benzylpiperidin-4-yl)-4-chlorobenzene-1,2-diamine
CID 22922520
3-[(1-phenylpiperidin-4-yl)amino]benzoic acid
CID 164589789
N-[3-(2-bromophenyl)cyclobutyl]-2,4-dichloroaniline
CID 43633020

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine?
The IUPAC name of N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine (CID 106820276) is N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine.
What is the SMILES notation for N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine?
The canonical SMILES for N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine is Clc1ccc(NC2CCN(c3ccccc3)CC2)c(Cl)c1.
What is the InChIKey of N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine?
The InChIKey is FEUYAZXOEAMMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2/c18-13-6-7-17(16(19)12-13)20-14-8-10-21(11-9-14)15-4-2-1-3-5-15/h1-7,12,14,20H,8-11H2.
What are the key properties of N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine?
N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine has a molecular weight of 321.25 g/mol, XLogP of 5.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine is sourced from PubChem (CID 106820276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).