2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine

C17H24Cl2N2 — CID 65317988

IUPAC2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cc(Cl)ccc2Cl)C(C2CC2)CN1
InChIInChI=1S/C17H24Cl2N2/c1-2-3-15-11-21(17(9-20-15)12-4-5-12)10-13-8-14(18)6-7-16(13)19/h6-8,12,15,17,20H,2-5,9-11H2,1H3
InChIKeyZGMIGALZVWZBNR-UHFFFAOYSA-N
MW327.30 g/mol
LogP4.35
Rot. Bonds5

About 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine

2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine (PubChem CID 65317988) has the molecular formula C17H24Cl2N2 and a molecular weight of 327.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine.

Molecular Properties

Compound Name2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine
PubChem CID65317988
Molecular FormulaC17H24Cl2N2
Molecular Weight327.30 g/mol
Exact Mass326.13
IUPAC Name2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cc(Cl)ccc2Cl)C(C2CC2)CN1
InChIInChI=1S/C17H24Cl2N2/c1-2-3-15-11-21(17(9-20-15)12-4-5-12)10-13-8-14(18)6-7-16(13)19/h6-8,12,15,17,20H,2-5,9-11H2,1H3
InChIKeyZGMIGALZVWZBNR-UHFFFAOYSA-N
XLogP4.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.30
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,5-dichlorophenyl)methyl]-2-methyl-5-propylpiperazine
CID 65317892
2-cyclopropyl-1-[(3,4-dichlorophenyl)methyl]-5-propylpiperazine
CID 64838200
1-benzyl-2-cyclopropyl-5-propylpiperazine
CID 64839373
1-[(2,5-dichlorophenyl)methyl]-5-ethyl-2-methylpiperazine
CID 65317608
2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5,5-dimethylpiperazine
CID 65317510
2-cyclopropyl-1-ethyl-5-propylpiperazine
CID 64838589
1-[(5-chloro-2-methoxyphenyl)methyl]-2-methyl-5-propylpiperazine
CID 64846366
1-[(4-chloro-3-fluorophenyl)methyl]-2-cyclopropyl-5-ethylpiperazine
CID 107888537
2-cyclopropyl-5-propyl-1-(pyridin-2-ylmethyl)piperazine
CID 64838011
2-cyclopropyl-1-(cyclopropylmethyl)-5-propylpiperazine
CID 64838783
2-cyclopropyl-1-[(3,4-difluorophenyl)methyl]-5-ethylpiperazine
CID 82924639
1-[(5-chloro-2-fluorophenyl)methyl]-5-cyclopropyl-2-propylpiperazine
CID 103050837

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine?
The IUPAC name of 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine (CID 65317988) is 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine.
What is the SMILES notation for 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine?
The canonical SMILES for 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine is CCCC1CN(Cc2cc(Cl)ccc2Cl)C(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine?
The InChIKey is ZGMIGALZVWZBNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24Cl2N2/c1-2-3-15-11-21(17(9-20-15)12-4-5-12)10-13-8-14(18)6-7-16(13)19/h6-8,12,15,17,20H,2-5,9-11H2,1H3.
What are the key properties of 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine?
2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine has a molecular weight of 327.30 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[(2,5-dichlorophenyl)methyl]-5-propylpiperazine is sourced from PubChem (CID 65317988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).