2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide

C15H12Cl2FNO3 — CID 167851526

IUPAC2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)c(OC)cc2Cl)cc1F
InChIInChI=1S/C15H12Cl2FNO3/c1-21-13-4-3-8(5-12(13)18)19-15(20)9-6-11(17)14(22-2)7-10(9)16/h3-7H,1-2H3,(H,19,20)
InChIKeyDOUQWDOIINBPSL-UHFFFAOYSA-N
MW344.17 g/mol
LogP4.40
Rot. Bonds4

About 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide

2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide (PubChem CID 167851526) has the molecular formula C15H12Cl2FNO3 and a molecular weight of 344.17 g/mol. Its IUPAC name is 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide
PubChem CID167851526
Molecular FormulaC15H12Cl2FNO3
Molecular Weight344.17 g/mol
Exact Mass343.02
IUPAC Name2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(NC(=O)c2cc(Cl)c(OC)cc2Cl)cc1F
InChIInChI=1S/C15H12Cl2FNO3/c1-21-13-4-3-8(5-12(13)18)19-15(20)9-6-11(17)14(22-2)7-10(9)16/h3-7H,1-2H3,(H,19,20)
InChIKeyDOUQWDOIINBPSL-UHFFFAOYSA-N
XLogP4.40
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.17
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
2-amino-3-fluoro-N-(3-fluoro-4-methoxyphenyl)benzamide
CID 62661511
4-fluoro-N-(3-fluoro-4-methoxyphenyl)-2-hydroxybenzamide
CID 103829787
N-(3-fluoro-4-methoxyphenyl)-2,6-dimethoxybenzamide
CID 110776470
N-(4-chloro-3-methoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 99842680
2-bromo-N-(3-fluoro-4-methoxyphenyl)-3-methylbenzamide
CID 103853347
2-amino-N-(3-fluoro-4-methoxyphenyl)-3-methylbenzamide
CID 43380395
3-chloro-N-(3-fluoro-4-methoxyphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62169174
2-amino-4-fluoro-N-(3-fluoro-4-methoxyphenyl)benzamide
CID 63109763
N-(3-fluoro-4-methoxyphenyl)-2-hydroxy-5-methylbenzamide
CID 43381005
2-amino-N-(3-fluoro-4-methoxyphenyl)pyridine-3-carboxamide
CID 62156147
N-(4-chloro-3-methoxyphenyl)-2-fluoro-3-methylbenzamide
CID 107271805

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide?
The IUPAC name of 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide (CID 167851526) is 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide?
The canonical SMILES for 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide is COc1ccc(NC(=O)c2cc(Cl)c(OC)cc2Cl)cc1F.
What is the InChIKey of 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide?
The InChIKey is DOUQWDOIINBPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FNO3/c1-21-13-4-3-8(5-12(13)18)19-15(20)9-6-11(17)14(22-2)7-10(9)16/h3-7H,1-2H3,(H,19,20).
What are the key properties of 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide?
2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide has a molecular weight of 344.17 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(3-fluoro-4-methoxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 167851526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).