2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide

C38H31F5N4O7 — CID 90177419

IUPAC2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
SMILESCOc1cc(NC(=O)Cc2cccc(OC(F)F)c2)ccc1-c1cnco1.COc1cc(NC(=O)Cc2ccccc2C(F)(F)F)ccc1-c1cnco1
InChIInChI=1S/C19H15F3N2O3.C19H16F2N2O4/c1-26-16-9-13(6-7-14(16)17-10-23-11-27-17)24-18(25)8-12-4-2-3-5-15(12)19(20,21)22;1-25-16-9-13(5-6-15(16)17-10-22-11-26-17)23-18(24)8-12-3-2-4-14(7-12)27-19(20)21/h2-7,9-11H,8H2,1H3,(H,24,25);2-7,9-11,19H,8H2,1H3,(H,23,24)
InChIKeyZSMUQAMYISNDOT-UHFFFAOYSA-N
MW750.68 g/mol
LogP8.68
Rot. Bonds12

About 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide

2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 90177419) has the molecular formula C38H31F5N4O7 and a molecular weight of 750.68 g/mol. Its IUPAC name is 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID90177419
Molecular FormulaC38H31F5N4O7
Molecular Weight750.68 g/mol
Exact Mass750.21
IUPAC Name2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide
SMILESCOc1cc(NC(=O)Cc2cccc(OC(F)F)c2)ccc1-c1cnco1.COc1cc(NC(=O)Cc2ccccc2C(F)(F)F)ccc1-c1cnco1
InChIInChI=1S/C19H15F3N2O3.C19H16F2N2O4/c1-26-16-9-13(6-7-14(16)17-10-23-11-27-17)24-18(25)8-12-4-2-3-5-15(12)19(20,21)22;1-25-16-9-13(5-6-15(16)17-10-22-11-26-17)23-18(24)8-12-3-2-4-14(7-12)27-19(20)21/h2-7,9-11H,8H2,1H3,(H,24,25);2-7,9-11,19H,8H2,1H3,(H,23,24)
InChIKeyZSMUQAMYISNDOT-UHFFFAOYSA-N
XLogP8.68
TPSA137.95 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds12
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500750.68
LogP ≤ 58.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N-phenylpropanediamide
CID 10338010
2-[3-[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]oxyethynoxyamino]phenyl]-N-phenylacetamide
CID 20766427
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
CID 67046910
bis(1-(2-chlorophenyl)-3-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]propan-2-one);1-(2-chlorophenyl)-3-(4-pyridin-4-ylphenyl)propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]propan-2-one;1-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]-3-[2-(trifluoromethyl)phenyl]propan-2-one;1-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]-3-(2-methoxyphenyl)propan-2-one;1-[3-(hydroxymethyl)-4-pyridin-4-ylphenyl]-3-phenylpropan-2-one
CID 161214006
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-methyl-3-phenylbutanamide
CID 90177469
N'-[3-(aminomethyl)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]oxamide;2,2,2-trifluoroacetic acid
CID 22558403
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-[(4-methylphenyl)methyl]urea
CID 12051287
[3-[methyl(propyl)amino]-1-phenylpropyl] N-[[3-[[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]carbamoylamino]phenyl]methyl]carbamate;2,2,2-trifluoroacetic acid
CID 162322339
tert-butyl N-[[4-[[2-[3-methoxy-4-(1,3-oxazol-5-yl)anilino]-2-oxoacetyl]amino]phenyl]methyl]carbamate
CID 20766988
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N'-[2-methyl-1-(3-methylphenyl)propan-2-yl]oxamide
CID 10179570
3-hydroxy-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]naphthalene-2-carboxamide
CID 20604821
1-(2-chloro-5-fluorophenyl)-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-[3-(difluoromethoxy)phenyl]propan-2-one;1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[2-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one;1-[3-(difluoromethoxy)phenyl]-3-[3-fluoro-4-(1,3-oxazol-5-yl)phenyl]propan-2-one
CID 165041246

Frequently Asked Questions

What is the IUPAC name of 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide (CID 90177419) is 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide is COc1cc(NC(=O)Cc2cccc(OC(F)F)c2)ccc1-c1cnco1.COc1cc(NC(=O)Cc2ccccc2C(F)(F)F)ccc1-c1cnco1.
What is the InChIKey of 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is ZSMUQAMYISNDOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O3.C19H16F2N2O4/c1-26-16-9-13(6-7-14(16)17-10-23-11-27-17)24-18(25)8-12-4-2-3-5-15(12)19(20,21)22;1-25-16-9-13(5-6-15(16)17-10-22-11-26-17)23-18(24)8-12-3-2-4-14(7-12)27-19(20)21/h2-7,9-11H,8H2,1H3,(H,24,25);2-7,9-11,19H,8H2,1H3,(H,23,24).
What are the key properties of 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide?
2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 750.68 g/mol, XLogP of 8.68, 12 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(difluoromethoxy)phenyl]-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide;N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 90177419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).