1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one

C24H30FN3O2 — CID 22390759

IUPAC1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1N(CCN2CCC(CCOc3ccccc3)CC2)CCN1c1ccc(F)cc1
InChIInChI=1S/C24H30FN3O2/c25-21-6-8-22(9-7-21)28-18-17-27(24(28)29)16-15-26-13-10-20(11-14-26)12-19-30-23-4-2-1-3-5-23/h1-9,20H,10-19H2
InChIKeyDUEALVPGJANUNA-UHFFFAOYSA-N
MW411.52 g/mol
LogP4.25
Rot. Bonds8

About 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one

1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one (PubChem CID 22390759) has the molecular formula C24H30FN3O2 and a molecular weight of 411.52 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one
PubChem CID22390759
Molecular FormulaC24H30FN3O2
Molecular Weight411.52 g/mol
Exact Mass411.23
IUPAC Name1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1N(CCN2CCC(CCOc3ccccc3)CC2)CCN1c1ccc(F)cc1
InChIInChI=1S/C24H30FN3O2/c25-21-6-8-22(9-7-21)28-18-17-27(24(28)29)16-15-26-13-10-20(11-14-26)12-19-30-23-4-2-1-3-5-23/h1-9,20H,10-19H2
InChIKeyDUEALVPGJANUNA-UHFFFAOYSA-N
XLogP4.25
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.52
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-oxo-3-[2-[4-(phenoxymethyl)piperidin-1-yl]ethyl]imidazolidin-1-yl]benzonitrile
CID 22390814
1-[2-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]ethyl]-3-(4-fluorophenyl)imidazolidin-2-one
CID 10503205
1-(cyclopropylmethyl)-4-[2-(4-fluorophenoxy)ethyl]piperidine;oxalic acid
CID 70056141
4-[2-(4-fluorophenoxy)ethyl]-1-pentylpiperidine
CID 54415158
4-bromo-5-[[4-[2-(4-fluorophenoxy)ethyl]piperidin-1-yl]methyl]-1-methyl-2-phenylpyrazol-3-one
CID 11612831
3-[1-[2-(4-fluorophenoxy)ethyl]piperidin-4-yl]propanoic acid
CID 62217888
2-[1-[3-(4-fluorophenoxy)propyl]piperidin-4-yl]ethanol
CID 139776336
1-[(4-fluorophenyl)methyl]-4-(2-phenylperoxyethyl)piperidine
CID 90197963
anisole;1-ethyl-4-(2-phenoxyethyl)piperidine
CID 174661948
1-(2-ethylbutyl)-4-[2-(4-fluorophenoxy)ethyl]piperidine
CID 70054145
2-[1-[2-(4-fluorophenoxy)ethyl]piperidin-4-yl]-N,N-dimethylethanamine
CID 19085444
1-[2-(azetidin-3-yl)ethyl]-3-phenylimidazolidin-2-one
CID 70500307

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one (CID 22390759) is 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one is O=C1N(CCN2CCC(CCOc3ccccc3)CC2)CCN1c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one?
The InChIKey is DUEALVPGJANUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30FN3O2/c25-21-6-8-22(9-7-21)28-18-17-27(24(28)29)16-15-26-13-10-20(11-14-26)12-19-30-23-4-2-1-3-5-23/h1-9,20H,10-19H2.
What are the key properties of 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one?
1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one has a molecular weight of 411.52 g/mol, XLogP of 4.25, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-[2-[4-(2-phenoxyethyl)piperidin-1-yl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 22390759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).