N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide

C19H19FN2O3 — CID 122493907

IUPACN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide
SMILESCC1=NC(CC(=O)Nc2ccc(OCc3cccc(F)c3)cc2)CO1
InChIInChI=1S/C19H19FN2O3/c1-13-21-17(12-24-13)10-19(23)22-16-5-7-18(8-6-16)25-11-14-3-2-4-15(20)9-14/h2-9,17H,10-12H2,1H3,(H,22,23)
InChIKeyCEHQDEKCJXBOQP-UHFFFAOYSA-N
MW342.37 g/mol
LogP3.55
Rot. Bonds6

About N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide

N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide (PubChem CID 122493907) has the molecular formula C19H19FN2O3 and a molecular weight of 342.37 g/mol. Its IUPAC name is N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide
PubChem CID122493907
Molecular FormulaC19H19FN2O3
Molecular Weight342.37 g/mol
Exact Mass342.14
IUPAC NameN-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide
SMILESCC1=NC(CC(=O)Nc2ccc(OCc3cccc(F)c3)cc2)CO1
InChIInChI=1S/C19H19FN2O3/c1-13-21-17(12-24-13)10-19(23)22-16-5-7-18(8-6-16)25-11-14-3-2-4-15(20)9-14/h2-9,17H,10-12H2,1H3,(H,22,23)
InChIKeyCEHQDEKCJXBOQP-UHFFFAOYSA-N
XLogP3.55
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl N-[4-[(3-fluorophenyl)methoxy]phenyl]carbamate
CID 110359980
(3S)-3-acetamido-4-chloro-N-[4-[(3-fluorophenyl)methoxy]phenyl]butanamide
CID 118057062
2-(cyclopropylmethylamino)-N-[3-fluoro-4-[(3-fluorophenyl)methoxy]phenyl]acetamide
CID 119773636
2-[4-[(3-fluorophenyl)methoxy]anilino]ethene-1,1,2-tricarbonitrile
CID 168608415
2-(3-fluorophenyl)-N-[4-(4-methoxyanilino)phenyl]acetamide
CID 112987540
N-[4-[(3-methylphenyl)methoxy]phenyl]acetamide
CID 8522252
4-[(3-fluorophenyl)methoxy]-N-propan-2-ylaniline
CID 155469561
methyl 3-[4-[(3-fluorophenyl)methoxy]phenoxy]propanoate
CID 69037597
2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylideneamino]oxy-N-phenylacetamide
CID 3263920
2-(3-methylphenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 113098761
4-amino-N-[3-[(3-fluorophenyl)methoxy]phenyl]pentanamide
CID 120560905
2-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 109010754

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide (CID 122493907) is N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide is CC1=NC(CC(=O)Nc2ccc(OCc3cccc(F)c3)cc2)CO1.
What is the InChIKey of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide?
The InChIKey is CEHQDEKCJXBOQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O3/c1-13-21-17(12-24-13)10-19(23)22-16-5-7-18(8-6-16)25-11-14-3-2-4-15(20)9-14/h2-9,17H,10-12H2,1H3,(H,22,23).
What are the key properties of N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide?
N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide has a molecular weight of 342.37 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-fluorophenyl)methoxy]phenyl]-2-(2-methyl-4,5-dihydro-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 122493907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).