1-(1-methoxypentan-2-yl)-2-methylpiperazine

C11H24N2O — CID 64931136

IUPAC1-(1-methoxypentan-2-yl)-2-methylpiperazine
SMILESCCCC(COC)N1CCNCC1C
InChIInChI=1S/C11H24N2O/c1-4-5-11(9-14-3)13-7-6-12-8-10(13)2/h10-12H,4-9H2,1-3H3
InChIKeyXXOATINZSIDTIP-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.10
Rot. Bonds5

About 1-(1-methoxypentan-2-yl)-2-methylpiperazine

1-(1-methoxypentan-2-yl)-2-methylpiperazine (PubChem CID 64931136) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-(1-methoxypentan-2-yl)-2-methylpiperazine.

Molecular Properties

Compound Name1-(1-methoxypentan-2-yl)-2-methylpiperazine
PubChem CID64931136
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-(1-methoxypentan-2-yl)-2-methylpiperazine
SMILESCCCC(COC)N1CCNCC1C
InChIInChI=1S/C11H24N2O/c1-4-5-11(9-14-3)13-7-6-12-8-10(13)2/h10-12H,4-9H2,1-3H3
InChIKeyXXOATINZSIDTIP-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypentan-2-yl)-2-methylpiperazine?
The IUPAC name of 1-(1-methoxypentan-2-yl)-2-methylpiperazine (CID 64931136) is 1-(1-methoxypentan-2-yl)-2-methylpiperazine.
What is the SMILES notation for 1-(1-methoxypentan-2-yl)-2-methylpiperazine?
The canonical SMILES for 1-(1-methoxypentan-2-yl)-2-methylpiperazine is CCCC(COC)N1CCNCC1C.
What is the InChIKey of 1-(1-methoxypentan-2-yl)-2-methylpiperazine?
The InChIKey is XXOATINZSIDTIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-4-5-11(9-14-3)13-7-6-12-8-10(13)2/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-(1-methoxypentan-2-yl)-2-methylpiperazine?
1-(1-methoxypentan-2-yl)-2-methylpiperazine has a molecular weight of 200.33 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypentan-2-yl)-2-methylpiperazine is sourced from PubChem (CID 64931136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).