4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide

C14H15FN2O3 — CID 146144104

IUPAC4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide
SMILESCCc1nc(C)c(COc2ccc(C(N)=O)cc2F)o1
InChIInChI=1S/C14H15FN2O3/c1-3-13-17-8(2)12(20-13)7-19-11-5-4-9(14(16)18)6-10(11)15/h4-6H,3,7H2,1-2H3,(H2,16,18)
InChIKeyKVOJQWQIDHCDQZ-UHFFFAOYSA-N
MW278.28 g/mol
LogP2.36
Rot. Bonds5

About 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide

4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide (PubChem CID 146144104) has the molecular formula C14H15FN2O3 and a molecular weight of 278.28 g/mol. Its IUPAC name is 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide.

Molecular Properties

Compound Name4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide
PubChem CID146144104
Molecular FormulaC14H15FN2O3
Molecular Weight278.28 g/mol
Exact Mass278.11
IUPAC Name4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide
SMILESCCc1nc(C)c(COc2ccc(C(N)=O)cc2F)o1
InChIInChI=1S/C14H15FN2O3/c1-3-13-17-8(2)12(20-13)7-19-11-5-4-9(14(16)18)6-10(11)15/h4-6H,3,7H2,1-2H3,(H2,16,18)
InChIKeyKVOJQWQIDHCDQZ-UHFFFAOYSA-N
XLogP2.36
TPSA78.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-4-(pyridin-2-ylmethoxy)benzamide;hydrochloride
CID 142684298
1-[3-fluoro-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanone
CID 112689447
4-[(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)methoxy]-3-fluorobenzamide
CID 139017294
ethyl 2-(3-fluoro-4-phenylmethoxyphenyl)-2-oxoacetate
CID 117486957
4-(difluoromethoxy)-3-fluorobenzamide
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CID 60870089
3-fluoro-4-(2-morpholin-4-ylethoxy)benzamide
CID 22318780
1-[3-fluoro-4-[(4-methylphenyl)methoxy]phenyl]-2,2-dimethylpropan-1-one
CID 159779846
3-fluoro-4-(2-pyrrolidin-1-ylethoxy)benzamide
CID 22318837
4-[(2-amino-4-methoxyphenoxy)methyl]-3-fluorobenzamide
CID 24697423
4-amino-3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
CID 103174395
ethyl 2-(3-fluoro-4-propoxyphenyl)-2-oxoacetate
CID 91655173

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide?
The IUPAC name of 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide (CID 146144104) is 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide.
What is the SMILES notation for 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide?
The canonical SMILES for 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide is CCc1nc(C)c(COc2ccc(C(N)=O)cc2F)o1.
What is the InChIKey of 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide?
The InChIKey is KVOJQWQIDHCDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O3/c1-3-13-17-8(2)12(20-13)7-19-11-5-4-9(14(16)18)6-10(11)15/h4-6H,3,7H2,1-2H3,(H2,16,18).
What are the key properties of 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide?
4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide has a molecular weight of 278.28 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methoxy]-3-fluorobenzamide is sourced from PubChem (CID 146144104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).