3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one

C14H17FN2O3 — CID 54515029

IUPAC3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one
SMILESCc1cc(F)c(-n2c(O)cn(C)c2=O)cc1OC(C)C
InChIInChI=1S/C14H17FN2O3/c1-8(2)20-12-6-11(10(15)5-9(12)3)17-13(18)7-16(4)14(17)19/h5-8,18H,1-4H3
InChIKeyYLVDJRTVQJCDQD-UHFFFAOYSA-N
MW280.30 g/mol
LogP2.12
Rot. Bonds3

About 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one

3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one (PubChem CID 54515029) has the molecular formula C14H17FN2O3 and a molecular weight of 280.30 g/mol. Its IUPAC name is 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one.

Molecular Properties

Compound Name3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one
PubChem CID54515029
Molecular FormulaC14H17FN2O3
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC Name3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one
SMILESCc1cc(F)c(-n2c(O)cn(C)c2=O)cc1OC(C)C
InChIInChI=1S/C14H17FN2O3/c1-8(2)20-12-6-11(10(15)5-9(12)3)17-13(18)7-16(4)14(17)19/h5-8,18H,1-4H3
InChIKeyYLVDJRTVQJCDQD-UHFFFAOYSA-N
XLogP2.12
TPSA56.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-ethoxyphenyl)-3-(3-fluoro-4-methylphenyl)-1H-imidazol-2-one
CID 4278722
1-[(4-Fluorophenyl)methyl]-3-(3-methoxyphenyl)-1-methylurea
CID 25690672
1-(3-Cyclopentyloxy-2-methylphenyl)-3-(2-hydroxyethyl)urea
CID 56827093
N-(3-ethoxy-4-methylphenyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
CID 71992369
1-(3-Cyclopentyloxy-2-methylphenyl)-3-(4-hydroxybutan-2-yl)urea
CID 72006097
3-(3-Cyclopentyloxy-2-methylphenyl)-1-(2-hydroxyethyl)-1-methylurea
CID 72009492
N-(3-ethoxy-4-methylphenyl)-5-oxa-8-azaspiro[3.5]nonane-8-carboxamide
CID 84593302
Urea, N,N-dimethyl-N'-(3-(2-phenylethoxy)phenyl)-
CID 156116
1,1-Dimethyl-3-(3-phenylmethoxyphenyl)urea
CID 20187257
N,N-diethyl-3-propan-2-yloxy-4-prop-1-enylaniline
CID 86098995
N,N-diethyl-3-propan-2-yloxy-4-[(E)-prop-1-enyl]aniline
CID 90039164
4-ethenyl-N,N-diethyl-3-propan-2-yloxyaniline
CID 134525236

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one?
The IUPAC name of 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one (CID 54515029) is 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one.
What is the SMILES notation for 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one?
The canonical SMILES for 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one is Cc1cc(F)c(-n2c(O)cn(C)c2=O)cc1OC(C)C.
What is the InChIKey of 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one?
The InChIKey is YLVDJRTVQJCDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O3/c1-8(2)20-12-6-11(10(15)5-9(12)3)17-13(18)7-16(4)14(17)19/h5-8,18H,1-4H3.
What are the key properties of 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one?
3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one has a molecular weight of 280.30 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-4-methyl-5-propan-2-yloxyphenyl)-4-hydroxy-1-methylimidazol-2-one is sourced from PubChem (CID 54515029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).