1-methyl-3-(2-methylpropyl)piperazine

C9H20N2 — CID 64833232

IUPAC1-methyl-3-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(C)CCN1
InChIInChI=1S/C9H20N2/c1-8(2)6-9-7-11(3)5-4-10-9/h8-10H,4-7H2,1-3H3
InChIKeyWOYCNJCWZDPJKK-UHFFFAOYSA-N
MW156.27 g/mol
LogP0.94
Rot. Bonds2

About 1-methyl-3-(2-methylpropyl)piperazine

1-methyl-3-(2-methylpropyl)piperazine (PubChem CID 64833232) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-methyl-3-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-methyl-3-(2-methylpropyl)piperazine
PubChem CID64833232
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-methyl-3-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(C)CCN1
InChIInChI=1S/C9H20N2/c1-8(2)6-9-7-11(3)5-4-10-9/h8-10H,4-7H2,1-3H3
InChIKeyWOYCNJCWZDPJKK-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-methylpropyl)piperazine?
The IUPAC name of 1-methyl-3-(2-methylpropyl)piperazine (CID 64833232) is 1-methyl-3-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-methyl-3-(2-methylpropyl)piperazine?
The canonical SMILES for 1-methyl-3-(2-methylpropyl)piperazine is CC(C)CC1CN(C)CCN1.
What is the InChIKey of 1-methyl-3-(2-methylpropyl)piperazine?
The InChIKey is WOYCNJCWZDPJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(2)6-9-7-11(3)5-4-10-9/h8-10H,4-7H2,1-3H3.
What are the key properties of 1-methyl-3-(2-methylpropyl)piperazine?
1-methyl-3-(2-methylpropyl)piperazine has a molecular weight of 156.27 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methylpropyl)piperazine is sourced from PubChem (CID 64833232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).