N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide

C15H13F2NO3 — CID 7336959

IUPACN-(3,5-difluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1OC
InChIInChI=1S/C15H13F2NO3/c1-20-13-4-3-9(5-14(13)21-2)15(19)18-12-7-10(16)6-11(17)8-12/h3-8H,1-2H3,(H,18,19)
InChIKeyNBWBWZVFGQWBNR-UHFFFAOYSA-N
MW293.27 g/mol
LogP3.23
Rot. Bonds4

About N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide

N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide (PubChem CID 7336959) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-3,4-dimethoxybenzamide
PubChem CID7336959
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC NameN-(3,5-difluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1OC
InChIInChI=1S/C15H13F2NO3/c1-20-13-4-3-9(5-14(13)21-2)15(19)18-12-7-10(16)6-11(17)8-12/h3-8H,1-2H3,(H,18,19)
InChIKeyNBWBWZVFGQWBNR-UHFFFAOYSA-N
XLogP3.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(3,5-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 24645355
dimethyl 5-[(3,4-dimethoxybenzoyl)amino]benzene-1,3-dicarboxylate
CID 1355426
N-(3-fluoro-4-hydroxyphenyl)-3,4-dimethoxybenzamide
CID 64781635
3-amino-N-(3-chloro-5-fluorophenyl)-4-methoxybenzamide
CID 107363446
3,4-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776412
N-(4-bromophenyl)-3,4-dimethoxybenzamide
CID 855033
N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
CID 966752
N-(3,5-difluorophenyl)-2,6-dimethoxybenzamide
CID 2989177
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
N-[4-[(4-tert-butylbenzoyl)amino]phenyl]-3,4-dimethoxybenzamide
CID 15994045
N-(3,4-dimethoxyphenyl)-4-fluoro-3-methylbenzamide
CID 63212434
N-[4-(2,6-difluoroanilino)phenyl]-3,4-dimethoxybenzamide
CID 112990211

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide (CID 7336959) is N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1OC.
What is the InChIKey of N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide?
The InChIKey is NBWBWZVFGQWBNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c1-20-13-4-3-9(5-14(13)21-2)15(19)18-12-7-10(16)6-11(17)8-12/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide?
N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide has a molecular weight of 293.27 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 7336959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).