1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine

C15H20Cl2N2 — CID 171294486

IUPAC1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine
SMILESClc1ccc([C@@H](CC2CC2)N2CCNCC2)c(Cl)c1
InChIInChI=1S/C15H20Cl2N2/c16-12-3-4-13(14(17)10-12)15(9-11-1-2-11)19-7-5-18-6-8-19/h3-4,10-11,15,18H,1-2,5-9H2/t15-/m1/s1
InChIKeyGICFEQCGDYCYAR-OAHLLOKOSA-N
MW299.24 g/mol
LogP3.74
Rot. Bonds4

About 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine

1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine (PubChem CID 171294486) has the molecular formula C15H20Cl2N2 and a molecular weight of 299.24 g/mol. Its IUPAC name is 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine
PubChem CID171294486
Molecular FormulaC15H20Cl2N2
Molecular Weight299.24 g/mol
Exact Mass298.10
IUPAC Name1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine
SMILESClc1ccc([C@@H](CC2CC2)N2CCNCC2)c(Cl)c1
InChIInChI=1S/C15H20Cl2N2/c16-12-3-4-13(14(17)10-12)15(9-11-1-2-11)19-7-5-18-6-8-19/h3-4,10-11,15,18H,1-2,5-9H2/t15-/m1/s1
InChIKeyGICFEQCGDYCYAR-OAHLLOKOSA-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

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Related Compounds

1-[(1S)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine;dihydrochloride
CID 171281867
1-[(1R)-1-(5-chloro-2-fluorophenyl)-2-cyclopropylethyl]piperazine
CID 171169090
4-chloro-2-[(1R)-2-cyclopropyl-1-piperazin-1-ylethyl]aniline
CID 171295504
3-chloro-4-[(1R)-2-cyclopropyl-1-piperazin-1-ylethyl]-N,N-dimethylaniline;dihydrochloride
CID 171294553
1-[(1R)-2-cyclopropyl-1-(2,3,5-trichlorophenyl)ethyl]piperazine;dihydrochloride
CID 171295322
1-[(1S)-2-cyclopropyl-1-(2,3,5-trichlorophenyl)ethyl]piperazine;dihydrochloride
CID 171282702
1-[(1S)-1-(3-chloro-4-fluorophenyl)-2-cyclopropylethyl]piperazine
CID 171163456
2-chloro-6-[(1S)-2-cyclopropyl-1-piperazin-1-ylethyl]-3-fluorophenol;dihydrochloride
CID 171297826
1-[(1S)-1-(2,4-dichlorophenyl)butyl]piperazine;dihydrochloride
CID 171281865
1-[(1R)-1-(3-chloro-4-fluorophenyl)-2-cyclopropylethyl]piperazine;hydrochloride
CID 171168859
1-[1-(2,4-dichlorophenyl)pentyl]piperazine
CID 5226884
1-[(1S)-1-(2,4-dichlorophenyl)-3,3,3-trifluoropropyl]piperazine;dihydrochloride
CID 171303036

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine?
The IUPAC name of 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine (CID 171294486) is 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine.
What is the SMILES notation for 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine?
The canonical SMILES for 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine is Clc1ccc([C@@H](CC2CC2)N2CCNCC2)c(Cl)c1.
What is the InChIKey of 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine?
The InChIKey is GICFEQCGDYCYAR-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H20Cl2N2/c16-12-3-4-13(14(17)10-12)15(9-11-1-2-11)19-7-5-18-6-8-19/h3-4,10-11,15,18H,1-2,5-9H2/t15-/m1/s1.
What are the key properties of 1-[(1R)-2-cyclopropyl-1-(2,4-dichlorophenyl)ethyl]piperazine?
1-[(1R)-2-cyclopropyl-1-(2,4-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-(2,4-dichlorophenyl)ethyl]piperazine is sourced from PubChem (CID 171294486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).