1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one

C15H20FN3O — CID 50742706

IUPAC1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one
SMILESO=C1N(Cc2cccc(F)c2)CCN1C1CCNCC1
InChIInChI=1S/C15H20FN3O/c16-13-3-1-2-12(10-13)11-18-8-9-19(15(18)20)14-4-6-17-7-5-14/h1-3,10,14,17H,4-9,11H2
InChIKeyVWERWUASJRYPHU-UHFFFAOYSA-N
MW277.34 g/mol
LogP1.82
Rot. Bonds3

About 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one

1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one (PubChem CID 50742706) has the molecular formula C15H20FN3O and a molecular weight of 277.34 g/mol. Its IUPAC name is 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one
PubChem CID50742706
Molecular FormulaC15H20FN3O
Molecular Weight277.34 g/mol
Exact Mass277.16
IUPAC Name1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one
SMILESO=C1N(Cc2cccc(F)c2)CCN1C1CCNCC1
InChIInChI=1S/C15H20FN3O/c16-13-3-1-2-12(10-13)11-18-8-9-19(15(18)20)14-4-6-17-7-5-14/h1-3,10,14,17H,4-9,11H2
InChIKeyVWERWUASJRYPHU-UHFFFAOYSA-N
XLogP1.82
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3-fluorophenyl)methyl]-3-[1-(furan-2-carbonyl)piperidin-4-yl]imidazolidin-2-one
CID 50789358
1-benzyl-3-pyrrolidin-3-ylimidazolidin-2-one
CID 82384888
1-(furan-2-ylmethyl)-3-piperidin-4-ylimidazolidin-2-one
CID 82383025
1-[(3-fluorophenyl)methyl]piperazine;dihydrochloride
CID 53422102
1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one
CID 50789317
1-[(3-fluorophenyl)methyl]aziridin-2-one
CID 88919956
(5aR,9aR)-4-[(3-fluorophenyl)methyl]-2,3,5a,6,7,8,9,9a-octahydropyrido[4,3-f][1,4]oxazepin-5-one
CID 97419386
1-[(2-chloro-4-methylphenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one
CID 106869368
1-ethyl-3-piperidin-4-ylimidazolidin-2-one;hydrochloride
CID 54593098
1-[1-(benzenesulfonyl)piperidin-4-yl]-3-[(4-fluorophenyl)methyl]imidazolidin-2-one
CID 53083134
1-[1-(2-cyclohexylacetyl)piperidin-4-yl]-4-[(3-fluorophenyl)methyl]piperazine-2,3-dione
CID 53004232
1-[(3-fluorophenyl)methyl]-4-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]piperazine-2,3-dione
CID 53004248

Frequently Asked Questions

What is the IUPAC name of 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one?
The IUPAC name of 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one (CID 50742706) is 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one.
What is the SMILES notation for 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one?
The canonical SMILES for 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one is O=C1N(Cc2cccc(F)c2)CCN1C1CCNCC1.
What is the InChIKey of 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one?
The InChIKey is VWERWUASJRYPHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O/c16-13-3-1-2-12(10-13)11-18-8-9-19(15(18)20)14-4-6-17-7-5-14/h1-3,10,14,17H,4-9,11H2.
What are the key properties of 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one?
1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one has a molecular weight of 277.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-fluorophenyl)methyl]-3-piperidin-4-ylimidazolidin-2-one is sourced from PubChem (CID 50742706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).