2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide

C20H27N3O3 — CID 87022626

IUPAC2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
SMILESCC(C)Cc1ccc(C(C)NC(=O)CN2C(=O)CN(C3CC3)C2=O)cc1
InChIInChI=1S/C20H27N3O3/c1-13(2)10-15-4-6-16(7-5-15)14(3)21-18(24)11-23-19(25)12-22(20(23)26)17-8-9-17/h4-7,13-14,17H,8-12H2,1-3H3,(H,21,24)
InChIKeyCKLFNZQGDZSWAJ-UHFFFAOYSA-N
MW357.45 g/mol
LogP2.49
Rot. Bonds7

About 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide

2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide (PubChem CID 87022626) has the molecular formula C20H27N3O3 and a molecular weight of 357.45 g/mol. Its IUPAC name is 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
PubChem CID87022626
Molecular FormulaC20H27N3O3
Molecular Weight357.45 g/mol
Exact Mass357.21
IUPAC Name2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
SMILESCC(C)Cc1ccc(C(C)NC(=O)CN2C(=O)CN(C3CC3)C2=O)cc1
InChIInChI=1S/C20H27N3O3/c1-13(2)10-15-4-6-16(7-5-15)14(3)21-18(24)11-23-19(25)12-22(20(23)26)17-8-9-17/h4-7,13-14,17H,8-12H2,1-3H3,(H,21,24)
InChIKeyCKLFNZQGDZSWAJ-UHFFFAOYSA-N
XLogP2.49
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-[1-(4-bromophenyl)ethyl]-2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 87022636
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 87022541
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 8014784
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 60519723
N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide
CID 9162371
N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 9092085
3-[(3aR,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-[(1R)-1-[4-(2-methylpropyl)phenyl]ethyl]propanamide
CID 8500657
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide;hydrochloride
CID 120775645
2-(3-cyano-6-oxopyridazin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 138005953
2-ethoxy-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 60636134
N-[1-[4-(2-methylpropyl)phenyl]ethyl]cyclopentanecarboxamide
CID 112791720
2-[(4R)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 92786542

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide?
The IUPAC name of 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide (CID 87022626) is 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide?
The canonical SMILES for 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide is CC(C)Cc1ccc(C(C)NC(=O)CN2C(=O)CN(C3CC3)C2=O)cc1.
What is the InChIKey of 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide?
The InChIKey is CKLFNZQGDZSWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O3/c1-13(2)10-15-4-6-16(7-5-15)14(3)21-18(24)11-23-19(25)12-22(20(23)26)17-8-9-17/h4-7,13-14,17H,8-12H2,1-3H3,(H,21,24).
What are the key properties of 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide?
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide has a molecular weight of 357.45 g/mol, XLogP of 2.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 87022626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).