4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide

C16H13F4NO4 — CID 8502681

IUPAC4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2OC(F)F)ccc1OC(F)F
InChIInChI=1S/C16H13F4NO4/c1-23-13-8-9(6-7-12(13)25-16(19)20)14(22)21-10-4-2-3-5-11(10)24-15(17)18/h2-8,15-16H,1H3,(H,21,22)
InChIKeyMUEHTTVMBMOSKX-UHFFFAOYSA-N
MW359.28 g/mol
LogP4.15
Rot. Bonds7

About 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide

4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide (PubChem CID 8502681) has the molecular formula C16H13F4NO4 and a molecular weight of 359.28 g/mol. Its IUPAC name is 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide.

Molecular Properties

Compound Name4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
PubChem CID8502681
Molecular FormulaC16H13F4NO4
Molecular Weight359.28 g/mol
Exact Mass359.08
IUPAC Name4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2OC(F)F)ccc1OC(F)F
InChIInChI=1S/C16H13F4NO4/c1-23-13-8-9(6-7-12(13)25-16(19)20)14(22)21-10-4-2-3-5-11(10)24-15(17)18/h2-8,15-16H,1H3,(H,21,22)
InChIKeyMUEHTTVMBMOSKX-UHFFFAOYSA-N
XLogP4.15
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.28
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(difluoromethoxy)-3-methoxy-N-(2-methylsulfanylphenyl)benzamide
CID 4864816
4-(difluoromethoxy)-3-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218194
4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
CID 2171846
N-[2-(difluoromethoxy)phenyl]-2,4,5-trimethoxybenzamide
CID 17394633
N-[2-(difluoromethoxy)phenyl]-3,4-dihydroxybenzamide
CID 103955493
N-[2-(difluoromethoxy)phenyl]naphthalene-2-carboxamide
CID 953096
3-chloro-N-[2-(difluoromethoxy)phenyl]-4-ethoxybenzamide
CID 1256588
N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide
CID 31079743
4-(difluoromethoxy)-3-methoxy-N-pyridin-4-ylbenzamide
CID 3461577
N-[2-(difluoromethoxy)phenyl]-3-ethoxybenzamide
CID 934563
N-(5-acetamido-2-chlorophenyl)-4-(difluoromethoxy)-3-methoxybenzamide
CID 55916592
4-(difluoromethoxy)-3-methoxy-N-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide
CID 26644330

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide?
The IUPAC name of 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide (CID 8502681) is 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide.
What is the SMILES notation for 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide?
The canonical SMILES for 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide is COc1cc(C(=O)Nc2ccccc2OC(F)F)ccc1OC(F)F.
What is the InChIKey of 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide?
The InChIKey is MUEHTTVMBMOSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F4NO4/c1-23-13-8-9(6-7-12(13)25-16(19)20)14(22)21-10-4-2-3-5-11(10)24-15(17)18/h2-8,15-16H,1H3,(H,21,22).
What are the key properties of 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide?
4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide has a molecular weight of 359.28 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide is sourced from PubChem (CID 8502681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).