4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one

C11H18N2O2 — CID 103707262

IUPAC4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one
SMILESCC1C(=O)NCCN1C(=O)CC1CCC1
InChIInChI=1S/C11H18N2O2/c1-8-11(15)12-5-6-13(8)10(14)7-9-3-2-4-9/h8-9H,2-7H2,1H3,(H,12,15)
InChIKeyVBXIRWRQPVWALP-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.52
Rot. Bonds2

About 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one

4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one (PubChem CID 103707262) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one.

Molecular Properties

Compound Name4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one
PubChem CID103707262
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one
SMILESCC1C(=O)NCCN1C(=O)CC1CCC1
InChIInChI=1S/C11H18N2O2/c1-8-11(15)12-5-6-13(8)10(14)7-9-3-2-4-9/h8-9H,2-7H2,1H3,(H,12,15)
InChIKeyVBXIRWRQPVWALP-UHFFFAOYSA-N
XLogP0.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-cyclohexylacetyl)-3-ethylpiperazin-2-one
CID 63600501
4-[2-(4-aminopiperidin-1-yl)acetyl]-3-methylpiperazin-2-one
CID 79328041
4-acetyl-3-methylpiperazin-2-one
CID 13190467
3-methyl-4-(2-piperazin-1-ylacetyl)piperazin-2-one
CID 63606730
2-[2-(2-methyl-3-oxopiperazin-1-yl)-2-oxoethyl]sulfanylacetic acid
CID 104569931
3-methyl-4-[3-(propan-2-ylamino)propanoyl]piperazin-2-one
CID 63607417
3-methyl-4-(2-thiomorpholin-3-ylacetyl)piperazin-2-one
CID 66421309
3-methyl-4-(2-morpholin-2-ylacetyl)piperazin-2-one;hydrochloride
CID 119760161
(3S)-3-methyl-4-prop-2-enoylpiperazin-2-one
CID 129371182
(2S)-1-(2-methyl-3-oxopiperazine-1-carbonyl)pyrrolidine-2-carboxylic acid
CID 78946545
3,3-dimethyl-5-[(2S)-2-methyl-3-oxopiperazin-1-yl]-5-oxopentanoic acid
CID 124555735
3-methyl-4-(3-piperidin-4-yloxypropanoyl)piperazin-2-one
CID 55251248

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one?
The IUPAC name of 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one (CID 103707262) is 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one.
What is the SMILES notation for 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one?
The canonical SMILES for 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one is CC1C(=O)NCCN1C(=O)CC1CCC1.
What is the InChIKey of 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one?
The InChIKey is VBXIRWRQPVWALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8-11(15)12-5-6-13(8)10(14)7-9-3-2-4-9/h8-9H,2-7H2,1H3,(H,12,15).
What are the key properties of 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one?
4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one has a molecular weight of 210.28 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclobutylacetyl)-3-methylpiperazin-2-one is sourced from PubChem (CID 103707262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).