(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one

C17H17FN2O2 — CID 97228892

IUPAC(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N[C@H]1c1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C17H17FN2O2/c1-20-10-16(21)19-17(20)13-4-8-15(9-5-13)22-11-12-2-6-14(18)7-3-12/h2-9,17H,10-11H2,1H3,(H,19,21)/t17-/m1/s1
InChIKeyBVTFPBCPCUXTRC-QGZVFWFLSA-N
MW300.33 g/mol
LogP2.46
Rot. Bonds4

About (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one

(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one (PubChem CID 97228892) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one.

Molecular Properties

Compound Name(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one
PubChem CID97228892
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one
SMILESCN1CC(=O)N[C@H]1c1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C17H17FN2O2/c1-20-10-16(21)19-17(20)13-4-8-15(9-5-13)22-11-12-2-6-14(18)7-3-12/h2-9,17H,10-11H2,1H3,(H,19,21)/t17-/m1/s1
InChIKeyBVTFPBCPCUXTRC-QGZVFWFLSA-N
XLogP2.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Safinamide
CID 131682
Pimavanserin
CID 10071196
Priralfinamide
CID 5745207
(2S,5R)-5-(4-((2-Fluorophenyl)methoxy)phenyl)-2-pyrrolidinecarboxamide
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Vixotrigine Hydrochloride
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2-({[4-(Benzyloxy)phenyl]methyl}amino)acetamide
CID 10588118
2-[2-[[5-[(4-Fluorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]-4,6-dioxo-1,3,5-triazin-2-yl]amino]ethyl]guanidine
CID 11950660
1-((4-Ethoxyphenyl)methyl)dihydro-2,4(1H,3H)-pyrimidinedione
CID 150653
1-Benzyl-3-[(4-methoxyphenyl)methyl]urea
CID 15323520
(2R)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]propanamide
CID 5487407
(S)-2-((4-(Benzyloxy)benzyl)amino)propanamide
CID 10517190
1-[(4-Fluorophenyl)methyl]-3-[[4-(2-methylpropoxy)phenyl]methyl]-1-piperidin-4-ylurea;hydrochloride
CID 68910730

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one?
The IUPAC name of (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one (CID 97228892) is (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one.
What is the SMILES notation for (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one?
The canonical SMILES for (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one is CN1CC(=O)N[C@H]1c1ccc(OCc2ccc(F)cc2)cc1.
What is the InChIKey of (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one?
The InChIKey is BVTFPBCPCUXTRC-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-20-10-16(21)19-17(20)13-4-8-15(9-5-13)22-11-12-2-6-14(18)7-3-12/h2-9,17H,10-11H2,1H3,(H,19,21)/t17-/m1/s1.
What are the key properties of (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one?
(2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one has a molecular weight of 300.33 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-[(4-fluorophenyl)methoxy]phenyl]-1-methylimidazolidin-4-one is sourced from PubChem (CID 97228892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).