(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide

C20H19FN2O3 — CID 40775968

IUPAC(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide
SMILESCC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(-c2ccc(C)cc2)no1
InChIInChI=1S/C20H19FN2O3/c1-3-18(25-16-10-8-15(21)9-11-16)20(24)22-19-12-17(23-26-19)14-6-4-13(2)5-7-14/h4-12,18H,3H2,1-2H3,(H,22,24)/t18-/m1/s1
InChIKeyLZJMDZHAJLHOAY-GOSISDBHSA-N
MW354.38 g/mol
LogP4.59
Rot. Bonds6

About (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide

(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide (PubChem CID 40775968) has the molecular formula C20H19FN2O3 and a molecular weight of 354.38 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide
PubChem CID40775968
Molecular FormulaC20H19FN2O3
Molecular Weight354.38 g/mol
Exact Mass354.14
IUPAC Name(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide
SMILESCC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(-c2ccc(C)cc2)no1
InChIInChI=1S/C20H19FN2O3/c1-3-18(25-16-10-8-15(21)9-11-16)20(24)22-19-12-17(23-26-19)14-6-4-13(2)5-7-14/h4-12,18H,3H2,1-2H3,(H,22,24)/t18-/m1/s1
InChIKeyLZJMDZHAJLHOAY-GOSISDBHSA-N
XLogP4.59
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(4-fluorophenoxy)-N-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]butanamide
CID 39868138
N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(4-methylphenyl)phenoxy]butanamide
CID 24533971
2-(4-fluorophenoxy)-N-(3-phenyl-1,2-oxazol-5-yl)propanamide
CID 17013988
2-(4-fluorophenoxy)-N-(3-methylphenyl)butanamide
CID 53284409
2-(4-fluorophenoxy)-N-(1,2-oxazol-3-yl)butanamide
CID 17249225
2-(4-fluorophenoxy)-N-[4-[(4-methylphenyl)sulfamoyl]phenyl]butanamide
CID 43885925
(2R)-2-(4-methylphenoxy)-N-(1,2-oxazol-3-yl)butanamide
CID 27233380
(2R)-N-(4-bromo-2-fluorophenyl)-2-(4-methylphenoxy)butanamide
CID 9179669
2-(4-fluorophenoxy)-N-(4-iodo-2-methylphenyl)butanamide
CID 43877200
2-(4-fluorophenoxy)-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide
CID 18853993
N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]-4-pentoxybenzamide
CID 35344022
2-(4-methylphenoxy)-N-(2,4,6-trimethylphenyl)butanamide
CID 4949931

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide?
The IUPAC name of (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide (CID 40775968) is (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide.
What is the SMILES notation for (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide?
The canonical SMILES for (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide is CC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(-c2ccc(C)cc2)no1.
What is the InChIKey of (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide?
The InChIKey is LZJMDZHAJLHOAY-GOSISDBHSA-N. The full InChI is InChI=1S/C20H19FN2O3/c1-3-18(25-16-10-8-15(21)9-11-16)20(24)22-19-12-17(23-26-19)14-6-4-13(2)5-7-14/h4-12,18H,3H2,1-2H3,(H,22,24)/t18-/m1/s1.
What are the key properties of (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide?
(2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide has a molecular weight of 354.38 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenoxy)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]butanamide is sourced from PubChem (CID 40775968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).