3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione

C11H15N3O3 — CID 82148391

IUPAC3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
SMILESCC(CN)N1C(=O)NC(C)(c2ccco2)C1=O
InChIInChI=1S/C11H15N3O3/c1-7(6-12)14-9(15)11(2,13-10(14)16)8-4-3-5-17-8/h3-5,7H,6,12H2,1-2H3,(H,13,16)
InChIKeyMYUDUWWAXMXDQA-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.39
Rot. Bonds3

About 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione

3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione (PubChem CID 82148391) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
PubChem CID82148391
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
SMILESCC(CN)N1C(=O)NC(C)(c2ccco2)C1=O
InChIInChI=1S/C11H15N3O3/c1-7(6-12)14-9(15)11(2,13-10(14)16)8-4-3-5-17-8/h3-5,7H,6,12H2,1-2H3,(H,13,16)
InChIKeyMYUDUWWAXMXDQA-UHFFFAOYSA-N
XLogP0.39
TPSA88.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-aminopropyl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 18073152
3-(1-aminopropan-2-yl)-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 82148377
(5R)-3-benzyl-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51462112
3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione
CID 82148372
7-(1-aminopropan-2-yl)-2-oxa-5,7-diazaspiro[3.4]octane-6,8-dione
CID 82397919
5-(furan-2-yl)-5-methyl-3-[2-[(propan-2-ylamino)methyl]prop-2-enyl]imidazolidine-2,4-dione
CID 103071810
(5R)-5-(furan-2-yl)-5-methyl-3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]imidazolidine-2,4-dione
CID 94139825
3-[2-(4-chlorophenyl)-2-hydroxyethyl]-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 47021034
(5S)-5-(furan-2-yl)-3-[2-(2-methoxyphenoxy)ethyl]-5-methylimidazolidine-2,4-dione
CID 94498941
(5R)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 709960
5-(furan-2-yl)-5-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]imidazolidine-2,4-dione
CID 46642091
tert-butyl 2-[4-(furan-2-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetate
CID 51259018

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione?
The IUPAC name of 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione (CID 82148391) is 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione is CC(CN)N1C(=O)NC(C)(c2ccco2)C1=O.
What is the InChIKey of 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione?
The InChIKey is MYUDUWWAXMXDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-7(6-12)14-9(15)11(2,13-10(14)16)8-4-3-5-17-8/h3-5,7H,6,12H2,1-2H3,(H,13,16).
What are the key properties of 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione?
3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione has a molecular weight of 237.26 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 82148391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).