2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide

C10H17N3O3 — CID 110686742

IUPAC2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1C(=O)CNC1=O
InChIInChI=1S/C10H17N3O3/c1-7(2)3-4-11-8(14)6-13-9(15)5-12-10(13)16/h7H,3-6H2,1-2H3,(H,11,14)(H,12,16)
InChIKeyLNSDNDWETAXHHL-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.30
Rot. Bonds5

About 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide

2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide (PubChem CID 110686742) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide
PubChem CID110686742
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1C(=O)CNC1=O
InChIInChI=1S/C10H17N3O3/c1-7(2)3-4-11-8(14)6-13-9(15)5-12-10(13)16/h7H,3-6H2,1-2H3,(H,11,14)(H,12,16)
InChIKeyLNSDNDWETAXHHL-UHFFFAOYSA-N
XLogP-0.30
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[[2-(2,5-dioxoimidazolidin-1-yl)acetyl]amino]ethoxy]acetic acid
CID 79457797
2-(2,5-dioxoimidazolidin-1-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide
CID 103725511
methyl 2-[[2-(2,5-dioxoimidazolidin-1-yl)acetyl]amino]propanoate
CID 60638121
N-[2-(4-tert-butylphenyl)ethyl]-2-(2,5-dioxoimidazolidin-1-yl)acetamide
CID 71941577
2-(2,5-dioxo-4-propan-2-ylimidazolidin-1-yl)-N-(3-methylbutyl)acetamide
CID 16568359
2-(2,5-dioxoimidazolidin-1-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 110686711
3-[[[2-(2,5-dioxoimidazolidin-1-yl)acetyl]amino]methyl]pentanoic acid
CID 81066774
2-(2,5-dioxoimidazolidin-1-yl)-N-(2,2-diphenylethyl)acetamide
CID 86975393
2-[(1R,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-(3-methylbutyl)acetamide
CID 98307452
2-(2,5-dioxoimidazolidin-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110686709
2-methylpropyl 2-(2,5-dioxoimidazolidin-1-yl)acetate
CID 137320376
2-(2,5-dioxoimidazolidin-1-yl)-N-[(1-hydroxycyclobutyl)methyl]acetamide
CID 113247255

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide (CID 110686742) is 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CN1C(=O)CNC1=O.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide?
The InChIKey is LNSDNDWETAXHHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-7(2)3-4-11-8(14)6-13-9(15)5-12-10(13)16/h7H,3-6H2,1-2H3,(H,11,14)(H,12,16).
What are the key properties of 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide?
2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide has a molecular weight of 227.26 g/mol, XLogP of -0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 110686742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).