4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide

C15H13F2NO3 — CID 2171846

IUPAC4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2)ccc1OC(F)F
InChIInChI=1S/C15H13F2NO3/c1-20-13-9-10(7-8-12(13)21-15(16)17)14(19)18-11-5-3-2-4-6-11/h2-9,15H,1H3,(H,18,19)
InChIKeyCUIKYZOADWKVHC-UHFFFAOYSA-N
MW293.27 g/mol
LogP3.55
Rot. Bonds5

About 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide

4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide (PubChem CID 2171846) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide.

Molecular Properties

Compound Name4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
PubChem CID2171846
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC Name4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2)ccc1OC(F)F
InChIInChI=1S/C15H13F2NO3/c1-20-13-9-10(7-8-12(13)21-15(16)17)14(19)18-11-5-3-2-4-6-11/h2-9,15H,1H3,(H,18,19)
InChIKeyCUIKYZOADWKVHC-UHFFFAOYSA-N
XLogP3.55
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(difluoromethoxy)-3-methoxy-N-pyridin-4-ylbenzamide
CID 3461577
4-(difluoromethoxy)-3-ethoxy-N-phenylbenzamide
CID 3461612
4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
CID 8502681
4-(difluoromethoxy)-3-methoxy-N-(4-sulfamoylphenyl)benzamide
CID 9314405
4-(difluoromethoxy)-3-methoxy-N-(2-methylsulfanylphenyl)benzamide
CID 4864816
N-[4-(diethylcarbamoyl)phenyl]-4-(difluoromethoxy)-3-methoxybenzamide
CID 8503672
methyl 2-[[3-[[4-(difluoromethoxy)-3-methoxybenzoyl]amino]benzoyl]amino]acetate
CID 55727946
N-(3-bromophenyl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 46482952
4-(difluoromethoxy)-3-methoxy-N-[4-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 55474776
4-(difluoromethoxy)-3-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218194
N-[4-(difluoromethoxy)-3-methoxyphenyl]-4-methylbenzamide
CID 4865288
4-(difluoromethoxy)-N-(1,1-diphenylethyl)-3-methoxybenzamide
CID 56522794

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide?
The IUPAC name of 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide (CID 2171846) is 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide.
What is the SMILES notation for 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide?
The canonical SMILES for 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide is COc1cc(C(=O)Nc2ccccc2)ccc1OC(F)F.
What is the InChIKey of 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide?
The InChIKey is CUIKYZOADWKVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c1-20-13-9-10(7-8-12(13)21-15(16)17)14(19)18-11-5-3-2-4-6-11/h2-9,15H,1H3,(H,18,19).
What are the key properties of 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide?
4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide has a molecular weight of 293.27 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-3-methoxy-N-phenylbenzamide is sourced from PubChem (CID 2171846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).