4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol

C11H24N2O — CID 79355088

IUPAC4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol
SMILESCC1CNCC(C)N1CCC(C)(C)O
InChIInChI=1S/C11H24N2O/c1-9-7-12-8-10(2)13(9)6-5-11(3,4)14/h9-10,12,14H,5-8H2,1-4H3
InChIKeyMNKBWSORGQGCNS-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.83
Rot. Bonds3

About 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol

4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol (PubChem CID 79355088) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol
PubChem CID79355088
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol
SMILESCC1CNCC(C)N1CCC(C)(C)O
InChIInChI=1S/C11H24N2O/c1-9-7-12-8-10(2)13(9)6-5-11(3,4)14/h9-10,12,14H,5-8H2,1-4H3
InChIKeyMNKBWSORGQGCNS-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol?
The IUPAC name of 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol (CID 79355088) is 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol.
What is the SMILES notation for 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol?
The canonical SMILES for 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol is CC1CNCC(C)N1CCC(C)(C)O.
What is the InChIKey of 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol?
The InChIKey is MNKBWSORGQGCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9-7-12-8-10(2)13(9)6-5-11(3,4)14/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol?
4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylpiperazin-1-yl)-2-methylbutan-2-ol is sourced from PubChem (CID 79355088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).