(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine

C15H24N2 — CID 166036202

IUPAC(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine
SMILESCC(C)Cc1cccc(N2CCNC[C@H]2C)c1
InChIInChI=1S/C15H24N2/c1-12(2)9-14-5-4-6-15(10-14)17-8-7-16-11-13(17)3/h4-6,10,12-13,16H,7-9,11H2,1-3H3/t13-/m1/s1
InChIKeyFKMPFJVFCDYYQM-CYBMUJFWSA-N
MW232.37 g/mol
LogP2.68
Rot. Bonds3

About (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine

(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine (PubChem CID 166036202) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine.

Molecular Properties

Compound Name(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine
PubChem CID166036202
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine
SMILESCC(C)Cc1cccc(N2CCNC[C@H]2C)c1
InChIInChI=1S/C15H24N2/c1-12(2)9-14-5-4-6-15(10-14)17-8-7-16-11-13(17)3/h4-6,10,12-13,16H,7-9,11H2,1-3H3/t13-/m1/s1
InChIKeyFKMPFJVFCDYYQM-CYBMUJFWSA-N
XLogP2.68
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 ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine?
The IUPAC name of (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine (CID 166036202) is (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine.
What is the SMILES notation for (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine?
The canonical SMILES for (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine is CC(C)Cc1cccc(N2CCNC[C@H]2C)c1.
What is the InChIKey of (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine?
The InChIKey is FKMPFJVFCDYYQM-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H24N2/c1-12(2)9-14-5-4-6-15(10-14)17-8-7-16-11-13(17)3/h4-6,10,12-13,16H,7-9,11H2,1-3H3/t13-/m1/s1.
What are the key properties of (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine?
(2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine has a molecular weight of 232.37 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-[3-(2-methylpropyl)phenyl]piperazine is sourced from PubChem (CID 166036202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).