N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide

C23H17FN2O3 — CID 55836607

IUPACN-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide
SMILESO=C(Nc1cccc(COc2cccc(F)c2)c1)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C23H17FN2O3/c24-19-4-2-6-21(12-19)28-14-16-3-1-5-20(11-16)26-23(27)18-9-7-17(8-10-18)22-13-25-15-29-22/h1-13,15H,14H2,(H,26,27)
InChIKeyDGWIAHAUDQSAOO-UHFFFAOYSA-N
MW388.40 g/mol
LogP5.31
Rot. Bonds6

About N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide

N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide (PubChem CID 55836607) has the molecular formula C23H17FN2O3 and a molecular weight of 388.40 g/mol. Its IUPAC name is N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide.

Molecular Properties

Compound NameN-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide
PubChem CID55836607
Molecular FormulaC23H17FN2O3
Molecular Weight388.40 g/mol
Exact Mass388.12
IUPAC NameN-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide
SMILESO=C(Nc1cccc(COc2cccc(F)c2)c1)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C23H17FN2O3/c24-19-4-2-6-21(12-19)28-14-16-3-1-5-20(11-16)26-23(27)18-9-7-17(8-10-18)22-13-25-15-29-22/h1-13,15H,14H2,(H,26,27)
InChIKeyDGWIAHAUDQSAOO-UHFFFAOYSA-N
XLogP5.31
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.40
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(3-fluorophenoxy)methyl]phenyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 38612951
3-amino-N-[3-[(3-fluorophenoxy)methyl]phenyl]pyrazine-2-carboxamide
CID 38613495
methyl 2-[4-[[3-[(3-fluorophenoxy)methyl]phenyl]carbamoyl]-2-methoxyphenoxy]acetate
CID 55778127
N-(3-fluorophenyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 58368181
N-[3-[(3-fluorophenoxy)methyl]phenyl]-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 38613381
N-[3-(phenoxymethyl)phenyl]-4-(trifluoromethyl)benzamide
CID 91610384
N-[3-[(3-fluorophenoxy)methyl]phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 38614359
N-(3-fluorophenyl)-1,3-oxazole-5-carboxamide
CID 96596303
4-methylsulfanyl-N-[3-(pyridin-3-ylmethoxy)phenyl]benzamide
CID 78890950
3-[(3-fluorophenoxy)methyl]benzohydrazide
CID 63576868
4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60811320
4-(1,3-oxazol-5-yl)-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]benzamide
CID 55836609

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide?
The IUPAC name of N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide (CID 55836607) is N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide.
What is the SMILES notation for N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide?
The canonical SMILES for N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide is O=C(Nc1cccc(COc2cccc(F)c2)c1)c1ccc(-c2cnco2)cc1.
What is the InChIKey of N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide?
The InChIKey is DGWIAHAUDQSAOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN2O3/c24-19-4-2-6-21(12-19)28-14-16-3-1-5-20(11-16)26-23(27)18-9-7-17(8-10-18)22-13-25-15-29-22/h1-13,15H,14H2,(H,26,27).
What are the key properties of N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide?
N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide has a molecular weight of 388.40 g/mol, XLogP of 5.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-fluorophenoxy)methyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide is sourced from PubChem (CID 55836607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).