N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide

C15H13F2NO3 — CID 966752

IUPACN-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(F)cc2F)cc1OC
InChIInChI=1S/C15H13F2NO3/c1-20-13-6-3-9(7-14(13)21-2)15(19)18-12-5-4-10(16)8-11(12)17/h3-8H,1-2H3,(H,18,19)
InChIKeyXIKMHVDNTWJNMK-UHFFFAOYSA-N
MW293.27 g/mol
LogP3.23
Rot. Bonds4

About N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide

N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide (PubChem CID 966752) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
PubChem CID966752
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC NameN-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(F)cc2F)cc1OC
InChIInChI=1S/C15H13F2NO3/c1-20-13-6-3-9(7-14(13)21-2)15(19)18-12-5-4-10(16)8-11(12)17/h3-8H,1-2H3,(H,18,19)
InChIKeyXIKMHVDNTWJNMK-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

4-bromo-N-(2,4-difluorophenyl)-3,5-dimethoxybenzamide
CID 26586057
3,4-dimethoxy-N-(2,3,4-trifluorophenyl)benzamide
CID 4879673
N-(2,4-difluorophenyl)-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109178399
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
4-(4-chloro-2-nitrophenoxy)-N-(2,4-difluorophenyl)-3-methoxybenzamide
CID 26681382
N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 26893672
N-(2,4-difluorophenyl)-5-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109245690
N-(3,5-difluorophenyl)-3,4-dimethoxybenzamide
CID 7336959
N-(2-fluoro-4-hydroxyphenyl)-3-methoxy-4-methylbenzamide
CID 64795336
N-(4-chloro-2-fluorophenyl)-3-methoxy-4-methylbenzamide
CID 26690340
3-bromo-N-(4-fluoro-2-iodophenyl)-4-methoxybenzamide
CID 79765984
4-butoxy-N-(2-fluoro-4-methylphenyl)-3-methoxybenzamide
CID 26522911

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide (CID 966752) is N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide is COc1ccc(C(=O)Nc2ccc(F)cc2F)cc1OC.
What is the InChIKey of N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide?
The InChIKey is XIKMHVDNTWJNMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c1-20-13-6-3-9(7-14(13)21-2)15(19)18-12-5-4-10(16)8-11(12)17/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide?
N-(2,4-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-(2,4-difluorophenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 966752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).