2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide

C16H21N3O2 — CID 110283187

IUPAC2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide
SMILESO=C(CC1NCCN(Cc2ccccc2)C1=O)NC1CC1
InChIInChI=1S/C16H21N3O2/c20-15(18-13-6-7-13)10-14-16(21)19(9-8-17-14)11-12-4-2-1-3-5-12/h1-5,13-14,17H,6-11H2,(H,18,20)
InChIKeyMUFKAKSLTFOSDB-UHFFFAOYSA-N
MW287.36 g/mol
LogP0.66
Rot. Bonds5

About 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide

2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide (PubChem CID 110283187) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide
PubChem CID110283187
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide
SMILESO=C(CC1NCCN(Cc2ccccc2)C1=O)NC1CC1
InChIInChI=1S/C16H21N3O2/c20-15(18-13-6-7-13)10-14-16(21)19(9-8-17-14)11-12-4-2-1-3-5-12/h1-5,13-14,17H,6-11H2,(H,18,20)
InChIKeyMUFKAKSLTFOSDB-UHFFFAOYSA-N
XLogP0.66
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclohexylacetamide;hydrochloride
CID 110283193
N-cyclopropyl-2-(4-ethyl-3-oxopiperazin-2-yl)acetamide
CID 110282604
2-[(2S)-4-benzyl-3-oxopiperazin-2-yl]-N-(4-chlorophenyl)acetamide
CID 7188924
2-(4-benzyl-3-oxopiperazin-2-yl)acetamide;hydrochloride
CID 110283164
2-(4-benzyl-3-oxopiperazin-2-yl)-N-[2-(dimethylamino)ethyl]acetamide
CID 110283183
3-[2-(azepan-1-yl)-2-oxoethyl]-1-benzylpiperazin-2-one
CID 110283147
2-(4-benzyl-3-oxopiperazin-2-yl)-N-(4-methoxyphenyl)acetamide;hydrochloride
CID 110283203
2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-diethylacetamide;hydrochloride
CID 110283124
1-benzyl-3-[2-(2-fluorophenyl)-2-oxoethyl]piperazin-2-one
CID 102002003
(3S)-1-benzyl-3-ethylpiperazin-2-one
CID 45095306
2-[(4S)-1-benzyl-2,5-dioxoimidazolidin-4-yl]-N-(1-benzylpiperidin-4-yl)acetamide
CID 75490912
2-(4-benzyl-3-oxopiperazin-2-yl)-N,N-dipropylacetamide
CID 110283149

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide?
The IUPAC name of 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide (CID 110283187) is 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide?
The canonical SMILES for 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide is O=C(CC1NCCN(Cc2ccccc2)C1=O)NC1CC1.
What is the InChIKey of 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide?
The InChIKey is MUFKAKSLTFOSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c20-15(18-13-6-7-13)10-14-16(21)19(9-8-17-14)11-12-4-2-1-3-5-12/h1-5,13-14,17H,6-11H2,(H,18,20).
What are the key properties of 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide?
2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide has a molecular weight of 287.36 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzyl-3-oxopiperazin-2-yl)-N-cyclopropylacetamide is sourced from PubChem (CID 110283187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).