2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one

C12H24N2O — CID 20659585

IUPAC2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one
SMILESCC(C)C(=O)C1CN(C)CCN1C(C)C
InChIInChI=1S/C12H24N2O/c1-9(2)12(15)11-8-13(5)6-7-14(11)10(3)4/h9-11H,6-8H2,1-5H3
InChIKeyCGQSUMCGESIWJA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds3

About 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one

2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one (PubChem CID 20659585) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one.

Molecular Properties

Compound Name2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one
PubChem CID20659585
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one
SMILESCC(C)C(=O)C1CN(C)CCN1C(C)C
InChIInChI=1S/C12H24N2O/c1-9(2)12(15)11-8-13(5)6-7-14(11)10(3)4/h9-11H,6-8H2,1-5H3
InChIKeyCGQSUMCGESIWJA-UHFFFAOYSA-N
XLogP1.24
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one?
The IUPAC name of 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one (CID 20659585) is 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one.
What is the SMILES notation for 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one?
The canonical SMILES for 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one is CC(C)C(=O)C1CN(C)CCN1C(C)C.
What is the InChIKey of 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one?
The InChIKey is CGQSUMCGESIWJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)12(15)11-8-13(5)6-7-14(11)10(3)4/h9-11H,6-8H2,1-5H3.
What are the key properties of 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one?
2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one has a molecular weight of 212.34 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-methyl-1-propan-2-ylpiperazin-2-yl)propan-1-one is sourced from PubChem (CID 20659585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).