1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one

C13H18N2O3 — CID 116979454

IUPAC1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one
SMILESCOc1ccccc1C1CN(CCCO)C(=O)N1
InChIInChI=1S/C13H18N2O3/c1-18-12-6-3-2-5-10(12)11-9-15(7-4-8-16)13(17)14-11/h2-3,5-6,11,16H,4,7-9H2,1H3,(H,14,17)
InChIKeyVBFNCKHVNGFWAS-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.14
Rot. Bonds5

About 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one

1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one (PubChem CID 116979454) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one
PubChem CID116979454
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one
SMILESCOc1ccccc1C1CN(CCCO)C(=O)N1
InChIInChI=1S/C13H18N2O3/c1-18-12-6-3-2-5-10(12)11-9-15(7-4-8-16)13(17)14-11/h2-3,5-6,11,16H,4,7-9H2,1H3,(H,14,17)
InChIKeyVBFNCKHVNGFWAS-UHFFFAOYSA-N
XLogP1.14
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-bromo-2-methoxyphenyl)-1-(3-hydroxypropyl)imidazolidin-2-one
CID 116979431
1-(3-hydroxypropyl)-4-(2-methoxyphenyl)-3-methylimidazolidin-2-one
CID 116982000
1-(3-aminopropyl)-4-(5-fluoro-2-methoxyphenyl)imidazolidin-2-one
CID 116978550
1-(4-aminobutan-2-yl)-4-(2-methoxyphenyl)imidazolidin-2-one
CID 116978676
4-(2-fluorophenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one
CID 116978623
1-(2-hydroxyethyl)-4-(1-methylindol-3-yl)imidazolidin-2-one
CID 116979364
4-(2,3-dichloro-6-hydroxyphenyl)-1-(3-hydroxypropyl)imidazolidin-2-one;ethane
CID 163241122
methyl 2-[4-(2-methylphenyl)-2-oxoimidazolidin-1-yl]acetate
CID 116980330
(2R)-2-(2-methoxyphenyl)azetidine
CID 92670019
3-[4-(2-methylphenyl)-2-oxoimidazolidin-1-yl]propanenitrile
CID 116980283
2-[4-(2,4-dimethoxyphenyl)-2-oxoimidazolidin-1-yl]acetonitrile
CID 116980156
3-[4-(2-bromophenyl)-2-oxoimidazolidin-1-yl]propanoic acid
CID 116979536

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one?
The IUPAC name of 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one (CID 116979454) is 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one?
The canonical SMILES for 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one is COc1ccccc1C1CN(CCCO)C(=O)N1.
What is the InChIKey of 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one?
The InChIKey is VBFNCKHVNGFWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-18-12-6-3-2-5-10(12)11-9-15(7-4-8-16)13(17)14-11/h2-3,5-6,11,16H,4,7-9H2,1H3,(H,14,17).
What are the key properties of 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one?
1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one has a molecular weight of 250.30 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypropyl)-4-(2-methoxyphenyl)imidazolidin-2-one is sourced from PubChem (CID 116979454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).