4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide

C22H18F2N2O3 — CID 24659050

IUPAC4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1OC(F)F)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18F2N2O3/c23-22(24)29-19-9-5-4-8-17(19)14-25-20(27)16-10-12-18(13-11-16)26-21(28)15-6-2-1-3-7-15/h1-13,22H,14H2,(H,25,27)(H,26,28)
InChIKeyQGTJEOJQRLVKRV-UHFFFAOYSA-N
MW396.39 g/mol
LogP4.47
Rot. Bonds7

About 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide

4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide (PubChem CID 24659050) has the molecular formula C22H18F2N2O3 and a molecular weight of 396.39 g/mol. Its IUPAC name is 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide
PubChem CID24659050
Molecular FormulaC22H18F2N2O3
Molecular Weight396.39 g/mol
Exact Mass396.13
IUPAC Name4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1OC(F)F)c1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18F2N2O3/c23-22(24)29-19-9-5-4-8-17(19)14-25-20(27)16-10-12-18(13-11-16)26-21(28)15-6-2-1-3-7-15/h1-13,22H,14H2,(H,25,27)(H,26,28)
InChIKeyQGTJEOJQRLVKRV-UHFFFAOYSA-N
XLogP4.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.39
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(benzenesulfonamido)-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide
CID 30254086
N-[4-[[2-(difluoromethoxy)phenyl]methylcarbamoylamino]phenyl]-2-methylpropanamide
CID 86987896
1-N-[(2-chlorophenyl)methyl]-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109047321
4-N-(4-fluorophenyl)-1-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046825
2-[[4-[[2-(2-propan-2-yloxyphenyl)acetyl]amino]benzoyl]amino]acetic acid
CID 119220475
1-[[2-(difluoromethoxy)phenyl]methyl]-3-(4-ethoxyphenyl)urea
CID 74225609
3-benzamido-N-[[5-bromo-2-(difluoromethoxy)phenyl]methyl]-4-methylbenzamide
CID 60615050
1-N-[[2-(difluoromethoxy)phenyl]methyl]-1-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
CID 47085091
N-[3-benzyl-4-(difluoromethoxy)phenyl]-4-[(carbamoylamino)methyl]benzamide
CID 24533543
4-(difluoromethoxy)-N-[(2-fluorophenyl)methyl]benzamide
CID 40650902
4-benzamido-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 55534844
N-[[2-(difluoromethoxy)phenyl]methyl]-3-[(2-fluorobenzoyl)amino]-4-methylbenzamide
CID 39294946

Frequently Asked Questions

What is the IUPAC name of 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide?
The IUPAC name of 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide (CID 24659050) is 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide is O=C(NCc1ccccc1OC(F)F)c1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide?
The InChIKey is QGTJEOJQRLVKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18F2N2O3/c23-22(24)29-19-9-5-4-8-17(19)14-25-20(27)16-10-12-18(13-11-16)26-21(28)15-6-2-1-3-7-15/h1-13,22H,14H2,(H,25,27)(H,26,28).
What are the key properties of 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide?
4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide has a molecular weight of 396.39 g/mol, XLogP of 4.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzamido-N-[[2-(difluoromethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 24659050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).