1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one

C17H17FN2O2 — CID 3717916

IUPAC1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one
SMILESCOc1cccc(CN2CCN(c3ccc(F)cc3)C2=O)c1
InChIInChI=1S/C17H17FN2O2/c1-22-16-4-2-3-13(11-16)12-19-9-10-20(17(19)21)15-7-5-14(18)6-8-15/h2-8,11H,9-10,12H2,1H3
InChIKeyMMKIDYHKURZXDQ-UHFFFAOYSA-N
MW300.33 g/mol
LogP3.28
Rot. Bonds4

About 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one

1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one (PubChem CID 3717916) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one
PubChem CID3717916
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one
SMILESCOc1cccc(CN2CCN(c3ccc(F)cc3)C2=O)c1
InChIInChI=1S/C17H17FN2O2/c1-22-16-4-2-3-13(11-16)12-19-9-10-20(17(19)21)15-7-5-14(18)6-8-15/h2-8,11H,9-10,12H2,1H3
InChIKeyMMKIDYHKURZXDQ-UHFFFAOYSA-N
XLogP3.28
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-methoxyphenyl)methyl]-4-phenylpiperazine-1-carboxamide
CID 9155553
1-(P-Anisyl)-3-benzylurea
CID 2822852
3-(P-Anisyl)-1,1-dibenzylurea
CID 3717527
2-(2,3-Dimethoxyphenyl)-1,3-diphenylimidazolidine
CID 1106964
1-(4-Methoxyphenyl)-3-(1-phenylethyl)urea
CID 2837289
N-[(3-methoxyphenyl)methyl]-4-phenylpiperazine-1-carboxamide
CID 9156648
N-[(2-methoxyphenyl)methyl]-4-phenylpiperazine-1-carboxamide
CID 9156652
N-[(3-methoxyphenyl)methyl]-4-(2-methylphenyl)piperazine-1-carboxamide
CID 9156673
N-(4-Methoxyphenyl)-N'-(4-phenylbutyl)urea
CID 24818737
1-[4-[(4-Ethylpiperazin-1-yl)methyl]phenyl]-3-(4-methoxyphenyl)urea
CID 5307861
N-(4-ethylphenyl)-N'-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea
CID 22430380
1H-Benzimidazole, 2,3-dihydro-2-(4-methoxyphenyl)-1,3-dimethyl-
CID 759319

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one?
The IUPAC name of 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one (CID 3717916) is 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one is COc1cccc(CN2CCN(c3ccc(F)cc3)C2=O)c1.
What is the InChIKey of 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one?
The InChIKey is MMKIDYHKURZXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-22-16-4-2-3-13(11-16)12-19-9-10-20(17(19)21)15-7-5-14(18)6-8-15/h2-8,11H,9-10,12H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one?
1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one has a molecular weight of 300.33 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-[(3-methoxyphenyl)methyl]imidazolidin-2-one is sourced from PubChem (CID 3717916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).