N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide

C14H17FN2O3 — CID 110685347

IUPACN-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
SMILESCN1CC(CCC(=O)NCc2ccccc2F)OC1=O
InChIInChI=1S/C14H17FN2O3/c1-17-9-11(20-14(17)19)6-7-13(18)16-8-10-4-2-3-5-12(10)15/h2-5,11H,6-9H2,1H3,(H,16,18)
InChIKeyPCKFBKOPOXHPBK-UHFFFAOYSA-N
MW280.30 g/mol
LogP1.67
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide

N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide (PubChem CID 110685347) has the molecular formula C14H17FN2O3 and a molecular weight of 280.30 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
PubChem CID110685347
Molecular FormulaC14H17FN2O3
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC NameN-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
SMILESCN1CC(CCC(=O)NCc2ccccc2F)OC1=O
InChIInChI=1S/C14H17FN2O3/c1-17-9-11(20-14(17)19)6-7-13(18)16-8-10-4-2-3-5-12(10)15/h2-5,11H,6-9H2,1H3,(H,16,18)
InChIKeyPCKFBKOPOXHPBK-UHFFFAOYSA-N
XLogP1.67
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-difluorophenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685519
2-(3-fluorophenyl)-N-[2-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)ethyl]acetamide
CID 110716952
N-(2-ethoxyphenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685451
N-[(2-fluorophenyl)methyl]-3-hydroxypropanamide
CID 115139087
N-[(2-fluorophenyl)methyl]-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 16621979
3-(1,3-dioxoisoindol-2-yl)-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]propanamide
CID 110710351
N-[(2-fluorophenyl)methyl]hexanamide
CID 17068300
N-[(2-fluorophenyl)methyl]-3-(2-oxo-1,3-thiazolidin-3-yl)propanamide
CID 9245524
N-(3-chloro-4-methylphenyl)-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide
CID 110685441
4-(3,4-dimethylphenyl)-N-[(2-fluorophenyl)methyl]-4-oxobutanamide
CID 9375029
1-benzyl-3-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]urea
CID 110747054
2-(2,4-dimethylpiperazin-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 71877586

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide (CID 110685347) is N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide is CN1CC(CCC(=O)NCc2ccccc2F)OC1=O.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide?
The InChIKey is PCKFBKOPOXHPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O3/c1-17-9-11(20-14(17)19)6-7-13(18)16-8-10-4-2-3-5-12(10)15/h2-5,11H,6-9H2,1H3,(H,16,18).
What are the key properties of N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide?
N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide has a molecular weight of 280.30 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)propanamide is sourced from PubChem (CID 110685347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).