N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide

C19H16F2N2O3 — CID 55637945

IUPACN-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide
SMILESCN(CCOc1ccc(F)cc1)C(=O)c1cc(-c2ccccc2F)on1
InChIInChI=1S/C19H16F2N2O3/c1-23(10-11-25-14-8-6-13(20)7-9-14)19(24)17-12-18(26-22-17)15-4-2-3-5-16(15)21/h2-9,12H,10-11H2,1H3
InChIKeyZUNHVJMFYLDNCY-UHFFFAOYSA-N
MW358.34 g/mol
LogP3.77
Rot. Bonds6

About N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide

N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide (PubChem CID 55637945) has the molecular formula C19H16F2N2O3 and a molecular weight of 358.34 g/mol. Its IUPAC name is N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide
PubChem CID55637945
Molecular FormulaC19H16F2N2O3
Molecular Weight358.34 g/mol
Exact Mass358.11
IUPAC NameN-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide
SMILESCN(CCOc1ccc(F)cc1)C(=O)c1cc(-c2ccccc2F)on1
InChIInChI=1S/C19H16F2N2O3/c1-23(10-11-25-14-8-6-13(20)7-9-14)19(24)17-12-18(26-22-17)15-4-2-3-5-16(15)21/h2-9,12H,10-11H2,1H3
InChIKeyZUNHVJMFYLDNCY-UHFFFAOYSA-N
XLogP3.77
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide
CID 37338212
6-fluoro-N-[2-(4-fluorophenoxy)ethyl]-N-methylpyridine-2-carboxamide
CID 115497073
(5R)-N-[2-(4-fluorophenoxy)ethyl]-3-(2-fluorophenyl)-N,5-dimethyl-4H-1,2-oxazole-5-carboxamide
CID 129385931
N-[2-(4-fluorophenoxy)ethyl]-N-methyl-1H-indazole-3-carboxamide
CID 18119662
1-(3-chlorophenyl)-N-[2-(4-fluorophenoxy)ethyl]-N-methylpyrazole-3-carboxamide
CID 55925389
phenyl N-[2-(4-fluorophenoxy)ethyl]-N-methylcarbamate
CID 60676113
N,3-dimethyl-N-[2-(4-methylphenoxy)ethyl]-1,2-oxazole-5-carboxamide
CID 134049963
(2R)-2-amino-N-[2-(4-fluorophenoxy)ethyl]-N-methylpropanamide
CID 54995498
2-[(4-chlorophenoxy)methyl]-N-[2-(2-fluorophenoxy)ethyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 46536356
6-chloro-N-[2-(4-fluorophenoxy)ethyl]-N-methylpyridine-3-carboxamide
CID 60676105
N-[2-(4-fluorophenoxy)ethyl]-N-methylquinoline-8-carboxamide
CID 18119617
N-[2-(4-bromophenoxy)ethyl]-N-methylpyridine-2-carboxamide
CID 112793960

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide (CID 55637945) is N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide is CN(CCOc1ccc(F)cc1)C(=O)c1cc(-c2ccccc2F)on1.
What is the InChIKey of N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is ZUNHVJMFYLDNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O3/c1-23(10-11-25-14-8-6-13(20)7-9-14)19(24)17-12-18(26-22-17)15-4-2-3-5-16(15)21/h2-9,12H,10-11H2,1H3.
What are the key properties of N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide?
N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 358.34 g/mol, XLogP of 3.77, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenoxy)ethyl]-5-(2-fluorophenyl)-N-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 55637945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).