1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one

C21H22FN3O3 — CID 70761450

IUPAC1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one
SMILESCc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cc1N1CCNC1=O
InChIInChI=1S/C21H22FN3O3/c1-14-2-3-16(12-18(14)25-9-8-23-21(25)27)20(26)24-10-11-28-19(13-24)15-4-6-17(22)7-5-15/h2-7,12,19H,8-11,13H2,1H3,(H,23,27)
InChIKeyQKXBJGAFWHJVHJ-UHFFFAOYSA-N
MW383.42 g/mol
LogP2.88
Rot. Bonds3

About 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one

1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one (PubChem CID 70761450) has the molecular formula C21H22FN3O3 and a molecular weight of 383.42 g/mol. Its IUPAC name is 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one
PubChem CID70761450
Molecular FormulaC21H22FN3O3
Molecular Weight383.42 g/mol
Exact Mass383.16
IUPAC Name1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one
SMILESCc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cc1N1CCNC1=O
InChIInChI=1S/C21H22FN3O3/c1-14-2-3-16(12-18(14)25-9-8-23-21(25)27)20(26)24-10-11-28-19(13-24)15-4-6-17(22)7-5-15/h2-7,12,19H,8-11,13H2,1H3,(H,23,27)
InChIKeyQKXBJGAFWHJVHJ-UHFFFAOYSA-N
XLogP2.88
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]methanesulfonamide
CID 134044426
1-[3-[(2R)-2-(4-bromophenyl)morpholine-4-carbonyl]phenyl]imidazolidin-2-one
CID 97077495
[2-(4-bromophenyl)morpholin-4-yl]-(4-fluorophenyl)methanone
CID 47913292
(2,3-dimethyl-1H-indol-5-yl)-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 38372236
(4-ethylphenyl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
CID 84545325
1-[5-(3-methoxypiperidine-1-carbonyl)-2-methylphenyl]imidazolidin-2-one
CID 70761074
1-[5-[(3R)-3-methoxypiperidine-1-carbonyl]-2-methylphenyl]imidazolidin-2-one
CID 97141117
1-[5-(3-amino-4-phenylpyrrolidine-1-carbonyl)-2-methylphenyl]imidazolidin-2-one
CID 156606116
1-[4-[(2R)-2-(4-fluorophenyl)morpholine-4-carbonyl]phenyl]pyrrolidin-2-one
CID 38372185
4-[3-[2-(4-fluorophenyl)morpholine-4-carbonyl]phenyl]sulfonylpiperazin-2-one
CID 42949393
[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-(3-hydroxy-4-nitrophenyl)methanone
CID 38374136
1-[2-methyl-5-(1-oxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl]imidazolidin-2-one
CID 56875042

Frequently Asked Questions

What is the IUPAC name of 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one?
The IUPAC name of 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one (CID 70761450) is 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one?
The canonical SMILES for 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one is Cc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cc1N1CCNC1=O.
What is the InChIKey of 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one?
The InChIKey is QKXBJGAFWHJVHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22FN3O3/c1-14-2-3-16(12-18(14)25-9-8-23-21(25)27)20(26)24-10-11-28-19(13-24)15-4-6-17(22)7-5-15/h2-7,12,19H,8-11,13H2,1H3,(H,23,27).
What are the key properties of 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one?
1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one has a molecular weight of 383.42 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[2-(4-fluorophenyl)morpholine-4-carbonyl]-2-methylphenyl]imidazolidin-2-one is sourced from PubChem (CID 70761450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).