2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide

C16H14F2N2O4 — CID 7278808

IUPAC2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C16H14F2N2O4/c17-16(18)24-13-8-4-2-6-11(13)20-14(21)9-23-12-7-3-1-5-10(12)15(19)22/h1-8,16H,9H2,(H2,19,22)(H,20,21)
InChIKeyATAVBIWROKUGGG-UHFFFAOYSA-N
MW336.29 g/mol
LogP2.40
Rot. Bonds7

About 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide

2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide (PubChem CID 7278808) has the molecular formula C16H14F2N2O4 and a molecular weight of 336.29 g/mol. Its IUPAC name is 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
PubChem CID7278808
Molecular FormulaC16H14F2N2O4
Molecular Weight336.29 g/mol
Exact Mass336.09
IUPAC Name2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C16H14F2N2O4/c17-16(18)24-13-8-4-2-6-11(13)20-14(21)9-23-12-7-3-1-5-10(12)15(19)22/h1-8,16H,9H2,(H2,19,22)(H,20,21)
InChIKeyATAVBIWROKUGGG-UHFFFAOYSA-N
XLogP2.40
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.29
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide (CID 7278808) is 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide is NC(=O)c1ccccc1OCC(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide?
The InChIKey is ATAVBIWROKUGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O4/c17-16(18)24-13-8-4-2-6-11(13)20-14(21)9-23-12-7-3-1-5-10(12)15(19)22/h1-8,16H,9H2,(H2,19,22)(H,20,21).
What are the key properties of 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide?
2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide has a molecular weight of 336.29 g/mol, XLogP of 2.40, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 7278808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).