3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide

C14H10Cl2FNO2 — CID 17102002

IUPAC3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide
SMILESCOc1c(Cl)cc(Cl)cc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H10Cl2FNO2/c1-20-13-11(5-8(15)6-12(13)16)14(19)18-10-4-2-3-9(17)7-10/h2-7H,1H3,(H,18,19)
InChIKeyYPUTVARWIWSBRT-UHFFFAOYSA-N
MW314.14 g/mol
LogP4.39
Rot. Bonds3

About 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide

3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide (PubChem CID 17102002) has the molecular formula C14H10Cl2FNO2 and a molecular weight of 314.14 g/mol. Its IUPAC name is 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide
PubChem CID17102002
Molecular FormulaC14H10Cl2FNO2
Molecular Weight314.14 g/mol
Exact Mass313.01
IUPAC Name3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide
SMILESCOc1c(Cl)cc(Cl)cc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C14H10Cl2FNO2/c1-20-13-11(5-8(15)6-12(13)16)14(19)18-10-4-2-3-9(17)7-10/h2-7H,1H3,(H,18,19)
InChIKeyYPUTVARWIWSBRT-UHFFFAOYSA-N
XLogP4.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.14
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide?
The IUPAC name of 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide (CID 17102002) is 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide.
What is the SMILES notation for 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide?
The canonical SMILES for 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide is COc1c(Cl)cc(Cl)cc1C(=O)Nc1cccc(F)c1.
What is the InChIKey of 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide?
The InChIKey is YPUTVARWIWSBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FNO2/c1-20-13-11(5-8(15)6-12(13)16)14(19)18-10-4-2-3-9(17)7-10/h2-7H,1H3,(H,18,19).
What are the key properties of 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide?
3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide has a molecular weight of 314.14 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(3-fluorophenyl)-2-methoxybenzamide is sourced from PubChem (CID 17102002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).