2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide

C17H16F2N2O3 — CID 26904916

IUPAC2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
SMILESCN(C)C(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1
InChIInChI=1S/C17H16F2N2O3/c1-21(2)16(23)11-7-9-12(10-8-11)20-15(22)13-5-3-4-6-14(13)24-17(18)19/h3-10,17H,1-2H3,(H,20,22)
InChIKeyQZGUQOFFGITFQN-UHFFFAOYSA-N
MW334.32 g/mol
LogP3.24
Rot. Bonds5

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

2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide (PubChem CID 26904916) has the molecular formula C17H16F2N2O3 and a molecular weight of 334.32 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
PubChem CID26904916
Molecular FormulaC17H16F2N2O3
Molecular Weight334.32 g/mol
Exact Mass334.11
IUPAC Name2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
SMILESCN(C)C(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1
InChIInChI=1S/C17H16F2N2O3/c1-21(2)16(23)11-7-9-12(10-8-11)20-15(22)13-5-3-4-6-14(13)24-17(18)19/h3-10,17H,1-2H3,(H,20,22)
InChIKeyQZGUQOFFGITFQN-UHFFFAOYSA-N
XLogP3.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.32
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(difluoromethoxy)-N-[[4-(dimethylcarbamoyl)phenyl]methyl]benzamide
CID 46422070
3-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 8698643
2-chloro-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 8698586
2-propan-2-yloxy-N-[4-[(2-propan-2-yloxybenzoyl)amino]phenyl]benzamide
CID 17046033
methyl 3-[[2-(difluoromethoxy)benzoyl]amino]benzoate
CID 17414154
2-(difluoromethoxy)-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CID 30857280
2-(difluoromethoxy)-N-ethylbenzamide
CID 60644731
N-[4-(methylcarbamoyl)phenyl]-2-propan-2-yloxybenzamide
CID 28642699
2-(difluoromethoxy)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 39977055
N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide
CID 17045479
N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide
CID 65436031
diethyl 5-[[2-(difluoromethoxy)benzoyl]amino]benzene-1,3-dicarboxylate
CID 26206682

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide (CID 26904916) is 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide is CN(C)C(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1.
What is the InChIKey of 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide?
The InChIKey is QZGUQOFFGITFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N2O3/c1-21(2)16(23)11-7-9-12(10-8-11)20-15(22)13-5-3-4-6-14(13)24-17(18)19/h3-10,17H,1-2H3,(H,20,22).
What are the key properties of 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide?
2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide has a molecular weight of 334.32 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 26904916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).