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

C18H15FN2O4 — CID 78903690

IUPACmethyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate
SMILESCOC(=O)Nc1ccc(OCc2ncc(-c3ccc(F)cc3)o2)cc1
InChIInChI=1S/C18H15FN2O4/c1-23-18(22)21-14-6-8-15(9-7-14)24-11-17-20-10-16(25-17)12-2-4-13(19)5-3-12/h2-10H,11H2,1H3,(H,21,22)
InChIKeyONGJUNGDJIGKNU-UHFFFAOYSA-N
MW342.33 g/mol
LogP4.24
Rot. Bonds5

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

methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate (PubChem CID 78903690) has the molecular formula C18H15FN2O4 and a molecular weight of 342.33 g/mol. Its IUPAC name is methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate.

Molecular Properties

Compound Namemethyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate
PubChem CID78903690
Molecular FormulaC18H15FN2O4
Molecular Weight342.33 g/mol
Exact Mass342.10
IUPAC Namemethyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate
SMILESCOC(=O)Nc1ccc(OCc2ncc(-c3ccc(F)cc3)o2)cc1
InChIInChI=1S/C18H15FN2O4/c1-23-18(22)21-14-6-8-15(9-7-14)24-11-17-20-10-16(25-17)12-2-4-13(19)5-3-12/h2-10H,11H2,1H3,(H,21,22)
InChIKeyONGJUNGDJIGKNU-UHFFFAOYSA-N
XLogP4.24
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.33
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]acetamide
CID 9353806
2-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9040276
N-methyl-4-[(5-phenyl-1,3-oxazol-2-yl)methoxy]aniline
CID 61027840
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methoxyphenyl)propanamide
CID 17437982
2-[(4-methoxyphenoxy)methyl]-5-phenyl-1,3-oxazole
CID 24961512
methyl 3-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methyl-methylamino]propanoate
CID 62012661
4-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanoylamino]-N-methylbenzamide
CID 16598099
methyl N-[4-[(2-bromo-4-fluorophenyl)methoxy]phenyl]carbamate
CID 60522492
N-[3-[(4-fluorophenyl)methoxy]phenyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 30839863
N-ethyl-4-[3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanoylamino]benzamide
CID 55802153
4-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methoxy]benzamide
CID 9356011
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylethanamine
CID 65182883

Frequently Asked Questions

What is the IUPAC name of methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate?
The IUPAC name of methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate (CID 78903690) is methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate.
What is the SMILES notation for methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate?
The canonical SMILES for methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate is COC(=O)Nc1ccc(OCc2ncc(-c3ccc(F)cc3)o2)cc1.
What is the InChIKey of methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate?
The InChIKey is ONGJUNGDJIGKNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O4/c1-23-18(22)21-14-6-8-15(9-7-14)24-11-17-20-10-16(25-17)12-2-4-13(19)5-3-12/h2-10H,11H2,1H3,(H,21,22).
What are the key properties of methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate?
methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate has a molecular weight of 342.33 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]phenyl]carbamate is sourced from PubChem (CID 78903690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).