1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine

C15H20Cl2N2 — CID 171284986

IUPAC1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine
SMILESClc1cccc(Cl)c1[C@@H](CC1CC1)N1CCNCC1
InChIInChI=1S/C15H20Cl2N2/c16-12-2-1-3-13(17)15(12)14(10-11-4-5-11)19-8-6-18-7-9-19/h1-3,11,14,18H,4-10H2/t14-/m1/s1
InChIKeyISPSJKLQNJGNSU-CQSZACIVSA-N
MW299.24 g/mol
LogP3.74
Rot. Bonds4

About 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine

1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine (PubChem CID 171284986) has the molecular formula C15H20Cl2N2 and a molecular weight of 299.24 g/mol. Its IUPAC name is 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine
PubChem CID171284986
Molecular FormulaC15H20Cl2N2
Molecular Weight299.24 g/mol
Exact Mass298.10
IUPAC Name1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine
SMILESClc1cccc(Cl)c1[C@@H](CC1CC1)N1CCNCC1
InChIInChI=1S/C15H20Cl2N2/c16-12-2-1-3-13(17)15(12)14(10-11-4-5-11)19-8-6-18-7-9-19/h1-3,11,14,18H,4-10H2/t14-/m1/s1
InChIKeyISPSJKLQNJGNSU-CQSZACIVSA-N
XLogP3.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.24
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine 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

1-[(1S)-1-(2-chloro-6-fluorophenyl)-2-cyclopropylethyl]piperazine;dihydrochloride
CID 171274071
1-[(1S)-2-cyclopropyl-1-(3,6-dichloro-2-fluorophenyl)ethyl]piperazine;dihydrochloride
CID 171283788
1-[(1R)-2-cyclopropyl-1-(2,3-dichloro-6-fluorophenyl)ethyl]piperazine
CID 171173184
3-bromo-6-chloro-2-[(1S)-2-cyclopropyl-1-piperazin-1-ylethyl]phenol
CID 171297705
1-[(1S)-1-(2,6-dichlorophenyl)-3-fluoropropyl]piperazine
CID 171162697
1-[(1R)-1-(2,6-dichlorophenyl)pent-4-enyl]piperazine
CID 171284992
(3S)-3-(2,6-dichlorophenyl)-3-piperazin-1-ylpropanenitrile
CID 171305748
1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine
CID 171294486
1-[(1S)-2-cyclopropyl-1-(2,3,4,5,6-pentafluorophenyl)ethyl]piperazine
CID 171166805
1-[(1S)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine;dihydrochloride
CID 171281867
1-[(1R)-1-(3-chloro-4-methylphenyl)-2-cyclopropylethyl]piperazine
CID 171289842
1-[(1S)-1-(3-chlorothiophen-2-yl)-2-cyclopropylethyl]piperazine;dihydrochloride
CID 171276249

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine?
The IUPAC name of 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine (CID 171284986) is 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine.
What is the SMILES notation for 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine?
The canonical SMILES for 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine is Clc1cccc(Cl)c1[C@@H](CC1CC1)N1CCNCC1.
What is the InChIKey of 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine?
The InChIKey is ISPSJKLQNJGNSU-CQSZACIVSA-N. The full InChI is InChI=1S/C15H20Cl2N2/c16-12-2-1-3-13(17)15(12)14(10-11-4-5-11)19-8-6-18-7-9-19/h1-3,11,14,18H,4-10H2/t14-/m1/s1.
What are the key properties of 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine?
1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine has a molecular weight of 299.24 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-cyclopropyl-1-(2,6-dichlorophenyl)ethyl]piperazine is sourced from PubChem (CID 171284986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).