2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one

C14H18N2O3 — CID 83270364

IUPAC2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C2CCOC2)cc1
InChIInChI=1S/C14H18N2O3/c1-18-12-4-2-10(3-5-12)14-15-8-13(17)16(14)11-6-7-19-9-11/h2-5,11,14-15H,6-9H2,1H3
InChIKeyIENNUZWKBDEKAN-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.91
Rot. Bonds3

About 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one

2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one (PubChem CID 83270364) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one
PubChem CID83270364
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C2CCOC2)cc1
InChIInChI=1S/C14H18N2O3/c1-18-12-4-2-10(3-5-12)14-15-8-13(17)16(14)11-6-7-19-9-11/h2-5,11,14-15H,6-9H2,1H3
InChIKeyIENNUZWKBDEKAN-UHFFFAOYSA-N
XLogP0.91
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one (CID 83270364) is 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one is COc1ccc(C2NCC(=O)N2C2CCOC2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one?
The InChIKey is IENNUZWKBDEKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-18-12-4-2-10(3-5-12)14-15-8-13(17)16(14)11-6-7-19-9-11/h2-5,11,14-15H,6-9H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one?
2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one has a molecular weight of 262.31 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-(oxolan-3-yl)imidazolidin-4-one is sourced from PubChem (CID 83270364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).