1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione

C12H20N2O3 — CID 86962942

IUPAC1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione
SMILESCOCCCCCN1C(=O)CN(C2CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-17-8-4-2-3-7-13-11(15)9-14(12(13)16)10-5-6-10/h10H,2-9H2,1H3
InChIKeyAOWWDAGLXJEWHU-UHFFFAOYSA-N
MW240.30 g/mol
LogP1.23
Rot. Bonds7

About 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione

1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione (PubChem CID 86962942) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione
PubChem CID86962942
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione
SMILESCOCCCCCN1C(=O)CN(C2CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-17-8-4-2-3-7-13-11(15)9-14(12(13)16)10-5-6-10/h10H,2-9H2,1H3
InChIKeyAOWWDAGLXJEWHU-UHFFFAOYSA-N
XLogP1.23
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-cyclopentyl-3-(methoxymethyl)imidazolidine-2,4-dione
CID 71972019
1-cyclopropyl-3-[2-(4-methoxyphenoxy)ethyl]imidazolidine-2,4-dione
CID 87022530
3-(2-methoxyethyl)-1-(1-pent-4-enoylpiperidin-4-yl)imidazolidine-2,4-dione
CID 131702775
1-[1-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperidin-4-yl]-3-(2-methoxyethyl)imidazolidine-2,4-dione
CID 124874232
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N,N-dimethylacetamide
CID 87022480
(3aR,7aS)-2-(5-methoxypentyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 98350564
2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-(3-methylbutan-2-yl)acetamide
CID 87022541
3-[3-(3-methoxypropyl)-2,4-dioxoimidazolidin-1-yl]benzoic acid
CID 80725792
1-(8-methoxyoctyl)-3-methyl-1,3-diazinane-2,4,6-trione;1-[2-(4-methoxyphenyl)ethyl]-3-methyl-1,3-diazinane-2,4,6-trione
CID 91393220
5-amino-1-(4-methoxybutyl)piperidin-2-one
CID 104650472
1-[1-(4-chloro-1,3-benzothiazol-2-yl)piperidin-4-yl]-3-(2-methoxyethyl)imidazolidine-2,4-dione
CID 155974661
1-[1-(4-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]-3-(2-methoxyethyl)imidazolidine-2,4-dione
CID 155974767

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione?
The IUPAC name of 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione (CID 86962942) is 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione is COCCCCCN1C(=O)CN(C2CC2)C1=O.
What is the InChIKey of 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione?
The InChIKey is AOWWDAGLXJEWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-17-8-4-2-3-7-13-11(15)9-14(12(13)16)10-5-6-10/h10H,2-9H2,1H3.
What are the key properties of 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione?
1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione has a molecular weight of 240.30 g/mol, XLogP of 1.23, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(5-methoxypentyl)imidazolidine-2,4-dione is sourced from PubChem (CID 86962942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).