2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine

C15H24N2 — CID 64952301

IUPAC2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine
SMILESCc1cccc(N2CC(C(C)C)NCC2C)c1
InChIInChI=1S/C15H24N2/c1-11(2)15-10-17(13(4)9-16-15)14-7-5-6-12(3)8-14/h5-8,11,13,15-16H,9-10H2,1-4H3
InChIKeyIGOPBDSRAFNSKJ-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.82
Rot. Bonds2

About 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine

2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine (PubChem CID 64952301) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine.

Molecular Properties

Compound Name2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine
PubChem CID64952301
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine
SMILESCc1cccc(N2CC(C(C)C)NCC2C)c1
InChIInChI=1S/C15H24N2/c1-11(2)15-10-17(13(4)9-16-15)14-7-5-6-12(3)8-14/h5-8,11,13,15-16H,9-10H2,1-4H3
InChIKeyIGOPBDSRAFNSKJ-UHFFFAOYSA-N
XLogP2.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine?
The IUPAC name of 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine (CID 64952301) is 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine.
What is the SMILES notation for 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine?
The canonical SMILES for 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine is Cc1cccc(N2CC(C(C)C)NCC2C)c1.
What is the InChIKey of 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine?
The InChIKey is IGOPBDSRAFNSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11(2)15-10-17(13(4)9-16-15)14-7-5-6-12(3)8-14/h5-8,11,13,15-16H,9-10H2,1-4H3.
What are the key properties of 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine?
2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine has a molecular weight of 232.37 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-methylphenyl)-5-propan-2-ylpiperazine is sourced from PubChem (CID 64952301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).