4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide

C16H16Cl2N2O3 — CID 24774276

IUPAC4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1cc(Cl)c(OCCN)c(Cl)c1
InChIInChI=1S/C16H16Cl2N2O3/c1-22-14-5-3-2-4-13(14)20-16(21)10-8-11(17)15(12(18)9-10)23-7-6-19/h2-5,8-9H,6-7,19H2,1H3,(H,20,21)
InChIKeyAWIXUOKVWGYYEB-UHFFFAOYSA-N
MW355.22 g/mol
LogP3.59
Rot. Bonds6

About 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide

4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide (PubChem CID 24774276) has the molecular formula C16H16Cl2N2O3 and a molecular weight of 355.22 g/mol. Its IUPAC name is 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide
PubChem CID24774276
Molecular FormulaC16H16Cl2N2O3
Molecular Weight355.22 g/mol
Exact Mass354.05
IUPAC Name4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1cc(Cl)c(OCCN)c(Cl)c1
InChIInChI=1S/C16H16Cl2N2O3/c1-22-14-5-3-2-4-13(14)20-16(21)10-8-11(17)15(12(18)9-10)23-7-6-19/h2-5,8-9H,6-7,19H2,1H3,(H,20,21)
InChIKeyAWIXUOKVWGYYEB-UHFFFAOYSA-N
XLogP3.59
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.22
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide (CID 24774276) is 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1cc(Cl)c(OCCN)c(Cl)c1.
What is the InChIKey of 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide?
The InChIKey is AWIXUOKVWGYYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O3/c1-22-14-5-3-2-4-13(14)20-16(21)10-8-11(17)15(12(18)9-10)23-7-6-19/h2-5,8-9H,6-7,19H2,1H3,(H,20,21).
What are the key properties of 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide?
4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide has a molecular weight of 355.22 g/mol, XLogP of 3.59, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethoxy)-3,5-dichloro-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 24774276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).