1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one

C17H20FN5O2 — CID 56815838

IUPAC1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2nnc(-c3ccc(F)cc3)o2)CC1
InChIInChI=1S/C17H20FN5O2/c18-13-3-1-12(2-4-13)16-21-20-15(25-16)11-22-8-5-14(6-9-22)23-10-7-19-17(23)24/h1-4,14H,5-11H2,(H,19,24)
InChIKeyNPQBFRFVOGVJPQ-UHFFFAOYSA-N
MW345.38 g/mol
LogP1.87
Rot. Bonds4

About 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 56815838) has the molecular formula C17H20FN5O2 and a molecular weight of 345.38 g/mol. Its IUPAC name is 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID56815838
Molecular FormulaC17H20FN5O2
Molecular Weight345.38 g/mol
Exact Mass345.16
IUPAC Name1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2nnc(-c3ccc(F)cc3)o2)CC1
InChIInChI=1S/C17H20FN5O2/c18-13-3-1-12(2-4-13)16-21-20-15(25-16)11-22-8-5-14(6-9-22)23-10-7-19-17(23)24/h1-4,14H,5-11H2,(H,19,24)
InChIKeyNPQBFRFVOGVJPQ-UHFFFAOYSA-N
XLogP1.87
TPSA74.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.38
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one with MolForge

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Related Compounds

1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-amine
CID 43556594
1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-4-methylpiperidin-4-ol
CID 80701819
1-[1-(1,3-benzoxazol-2-ylmethyl)piperidin-4-yl]imidazolidin-2-one
CID 56815353
2-(4-fluorophenyl)-5-[(3-methylpiperazin-1-yl)methyl]-1,3,4-oxadiazole
CID 65447710
1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one
CID 68820432
1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one
CID 94392496
(4-fluorophenyl)-[4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]methanone
CID 33218328
1-[[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidine-4-carbaldehyde
CID 62654115
[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]pyrrolidin-2-yl]methanol
CID 62013763
2-(4-fluorophenyl)-5-[(2-methylpiperazin-1-yl)methyl]-1,3,4-oxadiazole
CID 62672288
[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]pyrrolidin-2-yl]methanamine
CID 115312862
2-phenyl-5-[(4-phenylpiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 46643022

Frequently Asked Questions

What is the IUPAC name of 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one (CID 56815838) is 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(Cc2nnc(-c3ccc(F)cc3)o2)CC1.
What is the InChIKey of 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is NPQBFRFVOGVJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN5O2/c18-13-3-1-12(2-4-13)16-21-20-15(25-16)11-22-8-5-14(6-9-22)23-10-7-19-17(23)24/h1-4,14H,5-11H2,(H,19,24).
What are the key properties of 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 345.38 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 56815838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).