2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide

C16H23N3O2 — CID 3628343

IUPAC2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide
SMILESCCC(C)NC(=O)CN1CCN(Cc2ccccc2)C1=O
InChIInChI=1S/C16H23N3O2/c1-3-13(2)17-15(20)12-19-10-9-18(16(19)21)11-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H,17,20)
InChIKeyWABSDRJGPWVBKN-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.84
Rot. Bonds6

About 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide

2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide (PubChem CID 3628343) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide
PubChem CID3628343
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide
SMILESCCC(C)NC(=O)CN1CCN(Cc2ccccc2)C1=O
InChIInChI=1S/C16H23N3O2/c1-3-13(2)17-15(20)12-19-10-9-18(16(19)21)11-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H,17,20)
InChIKeyWABSDRJGPWVBKN-UHFFFAOYSA-N
XLogP1.84
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-benzyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(2R)-butan-2-yl]acetamide
CID 7819698
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-cyclopropylacetamide
CID 91653850
2-(2-oxopyrrolidin-1-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 47111292
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 4287057
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-[(2-bromophenyl)methyl]acetamide
CID 87049951
(3S)-1-benzyl-N-[(2R)-butan-2-yl]-5-oxopyrrolidine-3-carboxamide
CID 34269419
N-(3-methylbutyl)-2-[3-[(3-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
CID 4095945
2-[3-[(4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(2-phenylethyl)acetamide
CID 15999968
2-[4-[2-(N-benzylanilino)-2-oxoethyl]piperazin-1-yl]-N-butan-2-ylacetamide
CID 55566381
N-[(2R)-butan-2-yl]-2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]acetamide
CID 9258777
2-[3-[(4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(2-methylpropyl)acetamide
CID 87049850
(2R)-2-[[2-(4-ethyl-2,3-dioxopiperazin-1-yl)acetyl]amino]-3-phenylpropanoic acid
CID 119367288

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide?
The IUPAC name of 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide (CID 3628343) is 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide.
What is the SMILES notation for 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide?
The canonical SMILES for 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide is CCC(C)NC(=O)CN1CCN(Cc2ccccc2)C1=O.
What is the InChIKey of 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide?
The InChIKey is WABSDRJGPWVBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-13(2)17-15(20)12-19-10-9-18(16(19)21)11-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H,17,20).
What are the key properties of 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide?
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide has a molecular weight of 289.38 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-butan-2-ylacetamide is sourced from PubChem (CID 3628343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).