6-methyl-4-propylpiperazin-2-one

C8H16N2O — CID 129133704

IUPAC6-methyl-4-propylpiperazin-2-one
SMILESCCCN1CC(=O)NC(C)C1
InChIInChI=1S/C8H16N2O/c1-3-4-10-5-7(2)9-8(11)6-10/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyYBHYOFJWXVRUME-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.22
Rot. Bonds2

About 6-methyl-4-propylpiperazin-2-one

6-methyl-4-propylpiperazin-2-one (PubChem CID 129133704) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 6-methyl-4-propylpiperazin-2-one.

Molecular Properties

Compound Name6-methyl-4-propylpiperazin-2-one
PubChem CID129133704
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name6-methyl-4-propylpiperazin-2-one
SMILESCCCN1CC(=O)NC(C)C1
InChIInChI=1S/C8H16N2O/c1-3-4-10-5-7(2)9-8(11)6-10/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyYBHYOFJWXVRUME-UHFFFAOYSA-N
XLogP0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(6R)-4-ethyl-6-methylpiperazin-2-one
CID 171516065
4-ethyl-6-methylpiperazin-2-one
CID 89081094
4-(3-methyl-5-oxopiperazin-1-yl)butanenitrile
CID 130921073
1,6-dimethyl-4-propylpiperazin-2-one
CID 59261527
4-propylpiperazine-2,6-dione
CID 63787682
4-[(3,3-difluorocyclobutyl)methyl]-6-methylpiperazin-2-one
CID 126790707
4-[(4,4-difluorocyclohexyl)methyl]-6-methylpiperazin-2-one
CID 128702306
3-methyl-5-oxo-N-propylpiperazine-1-carbothioamide
CID 130948819
bis(6-methyl-4-(2-methylpropyl)piperazin-2-one);4-(2-methylpropyl)piperazin-2-one
CID 171515285
(1S,5S)-3-propyl-3-azabicyclo[3.2.1]octan-8-one
CID 98070007
(6S)-6-methyl-4-[(2,6,6-trimethylcyclohexen-1-yl)methyl]piperazin-2-one
CID 131896201
4-[[1-(4-chlorophenyl)-3-methylpyrazol-4-yl]methyl]-6-methylpiperazin-2-one
CID 146130340

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-propylpiperazin-2-one?
The IUPAC name of 6-methyl-4-propylpiperazin-2-one (CID 129133704) is 6-methyl-4-propylpiperazin-2-one.
What is the SMILES notation for 6-methyl-4-propylpiperazin-2-one?
The canonical SMILES for 6-methyl-4-propylpiperazin-2-one is CCCN1CC(=O)NC(C)C1.
What is the InChIKey of 6-methyl-4-propylpiperazin-2-one?
The InChIKey is YBHYOFJWXVRUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-3-4-10-5-7(2)9-8(11)6-10/h7H,3-6H2,1-2H3,(H,9,11).
What are the key properties of 6-methyl-4-propylpiperazin-2-one?
6-methyl-4-propylpiperazin-2-one has a molecular weight of 156.23 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-propylpiperazin-2-one is sourced from PubChem (CID 129133704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).