N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide

C14H13F3N2O3 — CID 75423629

IUPACN-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOc1ccccc1N(CC(F)(F)F)C(=O)Cc1ccon1
InChIInChI=1S/C14H13F3N2O3/c1-21-12-5-3-2-4-11(12)19(9-14(15,16)17)13(20)8-10-6-7-22-18-10/h2-7H,8-9H2,1H3
InChIKeyOZWBTFUZKPKEFR-UHFFFAOYSA-N
MW314.26 g/mol
LogP2.82
Rot. Bonds5

About N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide

N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 75423629) has the molecular formula C14H13F3N2O3 and a molecular weight of 314.26 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID75423629
Molecular FormulaC14H13F3N2O3
Molecular Weight314.26 g/mol
Exact Mass314.09
IUPAC NameN-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOc1ccccc1N(CC(F)(F)F)C(=O)Cc1ccon1
InChIInChI=1S/C14H13F3N2O3/c1-21-12-5-3-2-4-11(12)19(9-14(15,16)17)13(20)8-10-6-7-22-18-10/h2-7H,8-9H2,1H3
InChIKeyOZWBTFUZKPKEFR-UHFFFAOYSA-N
XLogP2.82
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.26
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(2-methoxyphenyl)-N-(1,2-oxazol-3-ylmethyl)-5-(trifluoromethyl)benzenesulfonamide
CID 78881130
2-[ethyl-[2-[2-methoxy-N-(2,2,2-trifluoroethyl)anilino]-2-oxoethyl]amino]-N-(3-methoxyphenyl)acetamide
CID 34437207
methyl 2-[3-methoxy-2-(1,2-oxazol-3-ylmethoxy)phenyl]acetate
CID 122142295
N-ethyl-N-(2-methoxyphenyl)benzamide
CID 138322543
N-(2-methoxyphenyl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78931832
N-ethyl-N-(2-methoxyphenyl)carbamate
CID 57360584
2-[2-methoxyethyl-[2-(1,2-oxazol-3-yl)acetyl]amino]acetic acid
CID 119189305
tert-butyl N-(3-fluoroprop-2-enyl)-N-(2-methoxyphenyl)carbamate
CID 70429366
N-(5-hydroxypentyl)-N-(2-methoxyphenyl)propanamide
CID 70548251
N-[2-(N-acetyl-2-methoxyanilino)ethyl]furan-2-carboxamide
CID 113060433
1-[2-(2-methoxyphenyl)ethyl]-3-(1,2-oxazol-3-yl)urea
CID 108812054
N-[(2-methoxyphenyl)methyl]-N'-(1,2-oxazol-3-yl)oxamide
CID 18588609

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide (CID 75423629) is N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide is COc1ccccc1N(CC(F)(F)F)C(=O)Cc1ccon1.
What is the InChIKey of N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is OZWBTFUZKPKEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O3/c1-21-12-5-3-2-4-11(12)19(9-14(15,16)17)13(20)8-10-6-7-22-18-10/h2-7H,8-9H2,1H3.
What are the key properties of N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide?
N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 314.26 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(1,2-oxazol-3-yl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 75423629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).