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

C15H19FN2O2 — CID 115065038

IUPAC3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one
SMILESO=C1OC(C2CCCNC2)CN1Cc1ccc(F)cc1
InChIInChI=1S/C15H19FN2O2/c16-13-5-3-11(4-6-13)9-18-10-14(20-15(18)19)12-2-1-7-17-8-12/h3-6,12,14,17H,1-2,7-10H2
InChIKeyHPLDTNJYJQVQLX-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.15
Rot. Bonds3

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

3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one (PubChem CID 115065038) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one
PubChem CID115065038
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one
SMILESO=C1OC(C2CCCNC2)CN1Cc1ccc(F)cc1
InChIInChI=1S/C15H19FN2O2/c16-13-5-3-11(4-6-13)9-18-10-14(20-15(18)19)12-2-1-7-17-8-12/h3-6,12,14,17H,1-2,7-10H2
InChIKeyHPLDTNJYJQVQLX-UHFFFAOYSA-N
XLogP2.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(3-hydroxyphenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one
CID 115065022
3-[(4-hydroxyphenyl)methyl]-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115065142
5-pyrrolidin-3-yl-3-[[3-(trifluoromethyl)phenyl]methyl]-1,3-oxazolidin-2-one
CID 115065111
3-[(2-hydroxyphenyl)methyl]-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115065131
3-cyclopropyl-5-piperidin-3-yl-1,3-oxazolidin-2-one
CID 115064955
3-(3-hydroxyphenyl)-5-piperidin-3-yl-1,3-oxazolidin-2-one
CID 115064972
5-piperidin-3-yl-3-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 115064963
3-(2,2-dimethylpropyl)-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115065107
5-(3-aminopropyl)-3-[(4-fluorophenyl)methyl]-1,3-oxazolidin-2-one
CID 115060075
3-[(4-fluorophenyl)methyl]-4-methyl-4-piperidin-3-yl-1,3-oxazolidin-2-one
CID 115064284
3-[[4-(4-fluorophenoxy)phenyl]methyl]-5-(4-fluorophenyl)-1,3-oxazolidin-2-one
CID 24967350
2-cyclopropyl-1-[(4-fluorophenyl)methyl]piperazine
CID 64833163

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one (CID 115065038) is 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one is O=C1OC(C2CCCNC2)CN1Cc1ccc(F)cc1.
What is the InChIKey of 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one?
The InChIKey is HPLDTNJYJQVQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c16-13-5-3-11(4-6-13)9-18-10-14(20-15(18)19)12-2-1-7-17-8-12/h3-6,12,14,17H,1-2,7-10H2.
What are the key properties of 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one?
3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one has a molecular weight of 278.33 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methyl]-5-piperidin-3-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115065038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).