1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine

C15H24N2 — CID 82289927

IUPAC1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine
SMILESCc1ccc(C)c(CC(C)N2CCNCC2)c1
InChIInChI=1S/C15H24N2/c1-12-4-5-13(2)15(10-12)11-14(3)17-8-6-16-7-9-17/h4-5,10,14,16H,6-9,11H2,1-3H3
InChIKeyNLJZHFWHBCCNCI-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.14
Rot. Bonds3

About 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine

1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine (PubChem CID 82289927) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine.

Molecular Properties

Compound Name1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine
PubChem CID82289927
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine
SMILESCc1ccc(C)c(CC(C)N2CCNCC2)c1
InChIInChI=1S/C15H24N2/c1-12-4-5-13(2)15(10-12)11-14(3)17-8-6-16-7-9-17/h4-5,10,14,16H,6-9,11H2,1-3H3
InChIKeyNLJZHFWHBCCNCI-UHFFFAOYSA-N
XLogP2.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[1-(4-methoxy-2,5-dimethylphenyl)propan-2-yl]piperazine
CID 82302982
1-[1-(2-methoxy-4,5-dimethylphenyl)propan-2-yl]piperazine
CID 82302972
1-[1-(2,4-dichlorophenyl)propan-2-yl]piperazine
CID 82255584
1-[1-(2,5-dimethylphenyl)ethyl]-1,4-diazepane
CID 3830311
1-[(1R)-1-(2,5-dimethylphenyl)-4,4,4-trifluorobutyl]piperazine;hydrochloride
CID 171173102
1-[1-(5-tert-butyl-2-methoxyphenyl)propan-2-yl]piperazine
CID 82255612
(2R)-1-[(2,5-dimethylphenyl)methyl]-2-methylpiperazine
CID 82713288
3-(2-piperazin-1-ylpropyl)-1H-pyridin-2-one
CID 83890200
1-[3-(2,5-dimethylphenyl)-2,2-dimethylpropyl]piperazine
CID 82302000
(2R)-2-(2,5-dimethylphenyl)-2-piperazin-1-ylethanol;hydrochloride
CID 171183677
2-methyl-3-(2-piperazin-1-ylpropyl)indolizine
CID 116993695
N-[2-(4-methylphenyl)ethyl]-2-piperazin-1-ylpropan-1-amine
CID 115255755

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine?
The IUPAC name of 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine (CID 82289927) is 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine.
What is the SMILES notation for 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine?
The canonical SMILES for 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine is Cc1ccc(C)c(CC(C)N2CCNCC2)c1.
What is the InChIKey of 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine?
The InChIKey is NLJZHFWHBCCNCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-4-5-13(2)15(10-12)11-14(3)17-8-6-16-7-9-17/h4-5,10,14,16H,6-9,11H2,1-3H3.
What are the key properties of 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine?
1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine has a molecular weight of 232.37 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,5-dimethylphenyl)propan-2-yl]piperazine is sourced from PubChem (CID 82289927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).