2-(2-methoxypropan-2-yl)-1-methylpiperazine

C9H20N2O — CID 173469720

IUPAC2-(2-methoxypropan-2-yl)-1-methylpiperazine
SMILESCOC(C)(C)C1CNCCN1C
InChIInChI=1S/C9H20N2O/c1-9(2,12-4)8-7-10-5-6-11(8)3/h8,10H,5-7H2,1-4H3
InChIKeyABFJNOYMWHJJSS-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.31
Rot. Bonds2

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

2-(2-methoxypropan-2-yl)-1-methylpiperazine (PubChem CID 173469720) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(2-methoxypropan-2-yl)-1-methylpiperazine.

Molecular Properties

Compound Name2-(2-methoxypropan-2-yl)-1-methylpiperazine
PubChem CID173469720
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(2-methoxypropan-2-yl)-1-methylpiperazine
SMILESCOC(C)(C)C1CNCCN1C
InChIInChI=1S/C9H20N2O/c1-9(2,12-4)8-7-10-5-6-11(8)3/h8,10H,5-7H2,1-4H3
InChIKeyABFJNOYMWHJJSS-UHFFFAOYSA-N
XLogP0.31
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxypropan-2-yl)-1-methylpiperazine?
The IUPAC name of 2-(2-methoxypropan-2-yl)-1-methylpiperazine (CID 173469720) is 2-(2-methoxypropan-2-yl)-1-methylpiperazine.
What is the SMILES notation for 2-(2-methoxypropan-2-yl)-1-methylpiperazine?
The canonical SMILES for 2-(2-methoxypropan-2-yl)-1-methylpiperazine is COC(C)(C)C1CNCCN1C.
What is the InChIKey of 2-(2-methoxypropan-2-yl)-1-methylpiperazine?
The InChIKey is ABFJNOYMWHJJSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-9(2,12-4)8-7-10-5-6-11(8)3/h8,10H,5-7H2,1-4H3.
What are the key properties of 2-(2-methoxypropan-2-yl)-1-methylpiperazine?
2-(2-methoxypropan-2-yl)-1-methylpiperazine has a molecular weight of 172.27 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxypropan-2-yl)-1-methylpiperazine is sourced from PubChem (CID 173469720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).