1,3,3,4,5,5-hexamethylpiperazin-2-one

C10H20N2O — CID 18728791

IUPAC1,3,3,4,5,5-hexamethylpiperazin-2-one
SMILESCN1CC(C)(C)N(C)C(C)(C)C1=O
InChIInChI=1S/C10H20N2O/c1-9(2)7-11(5)8(13)10(3,4)12(9)6/h7H2,1-6H3
InChIKeyWNOWBRDWVSDLDV-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.95
Rot. Bonds

About 1,3,3,4,5,5-hexamethylpiperazin-2-one

1,3,3,4,5,5-hexamethylpiperazin-2-one (PubChem CID 18728791) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1,3,3,4,5,5-hexamethylpiperazin-2-one.

Molecular Properties

Compound Name1,3,3,4,5,5-hexamethylpiperazin-2-one
PubChem CID18728791
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1,3,3,4,5,5-hexamethylpiperazin-2-one
SMILESCN1CC(C)(C)N(C)C(C)(C)C1=O
InChIInChI=1S/C10H20N2O/c1-9(2)7-11(5)8(13)10(3,4)12(9)6/h7H2,1-6H3
InChIKeyWNOWBRDWVSDLDV-UHFFFAOYSA-N
XLogP0.95
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3,3,4,5,5-hexamethylpiperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3,3,4,5,5-hexamethylpiperazin-2-one?
The IUPAC name of 1,3,3,4,5,5-hexamethylpiperazin-2-one (CID 18728791) is 1,3,3,4,5,5-hexamethylpiperazin-2-one.
What is the SMILES notation for 1,3,3,4,5,5-hexamethylpiperazin-2-one?
The canonical SMILES for 1,3,3,4,5,5-hexamethylpiperazin-2-one is CN1CC(C)(C)N(C)C(C)(C)C1=O.
What is the InChIKey of 1,3,3,4,5,5-hexamethylpiperazin-2-one?
The InChIKey is WNOWBRDWVSDLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(2)7-11(5)8(13)10(3,4)12(9)6/h7H2,1-6H3.
What are the key properties of 1,3,3,4,5,5-hexamethylpiperazin-2-one?
1,3,3,4,5,5-hexamethylpiperazin-2-one has a molecular weight of 184.28 g/mol, XLogP of 0.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,4,5,5-hexamethylpiperazin-2-one is sourced from PubChem (CID 18728791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).