1-methyl-4-(2-methylpropyl)piperazine

C9H20N2 — CID 20562082

IUPAC1-methyl-4-(2-methylpropyl)piperazine
SMILESCC(C)CN1CCN(C)CC1
InChIInChI=1S/C9H20N2/c1-9(2)8-11-6-4-10(3)5-7-11/h9H,4-8H2,1-3H3
InChIKeyKMOPAZSPIIQQOA-UHFFFAOYSA-N
MW156.27 g/mol
LogP0.89
Rot. Bonds2

About 1-methyl-4-(2-methylpropyl)piperazine

1-methyl-4-(2-methylpropyl)piperazine (PubChem CID 20562082) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 1-methyl-4-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(2-methylpropyl)piperazine
PubChem CID20562082
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name1-methyl-4-(2-methylpropyl)piperazine
SMILESCC(C)CN1CCN(C)CC1
InChIInChI=1S/C9H20N2/c1-9(2)8-11-6-4-10(3)5-7-11/h9H,4-8H2,1-3H3
InChIKeyKMOPAZSPIIQQOA-UHFFFAOYSA-N
XLogP0.89
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-(2-methylpropyl)-1,4-diazepane
CID 58719890
1-ethyl-4,7-dimethyl-10-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane
CID 118545612
1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
CID 165044772
2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
CID 4742453
1-methyl-4-[(2S)-2-methylbutyl]piperazine
CID 130224614
iron(6+);(2S)-1-[4-methyl-7-[(2S)-2-oxidopropyl]-1,4,7-triazonan-1-yl]propan-2-olate
CID 153461646
[4-(2-methylpropyl)piperazin-1-yl]methanol
CID 58575664
1-(2,2-difluoroethyl)-4-methylpiperazine
CID 76646739
3-methyl-1-(4-methylpiperazin-1-yl)butan-2-amine
CID 43199421
1-(4-methylpentyl)-4-(2-methylpropyl)piperazine
CID 21131473
1-methyl-4-[(2S)-2-methylsulfanylpropyl]piperazine
CID 155404296
4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]morpholine
CID 91228276

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-methylpropyl)piperazine?
The IUPAC name of 1-methyl-4-(2-methylpropyl)piperazine (CID 20562082) is 1-methyl-4-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-methyl-4-(2-methylpropyl)piperazine?
The canonical SMILES for 1-methyl-4-(2-methylpropyl)piperazine is CC(C)CN1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(2-methylpropyl)piperazine?
The InChIKey is KMOPAZSPIIQQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-9(2)8-11-6-4-10(3)5-7-11/h9H,4-8H2,1-3H3.
What are the key properties of 1-methyl-4-(2-methylpropyl)piperazine?
1-methyl-4-(2-methylpropyl)piperazine has a molecular weight of 156.27 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-methylpropyl)piperazine is sourced from PubChem (CID 20562082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).