5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide

C15H14Cl2N2O2 — CID 107623034

IUPAC5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)c(OC)c1
InChIInChI=1S/C15H14Cl2N2O2/c1-18-13-6-3-9(16)7-11(13)15(20)19-10-4-5-12(17)14(8-10)21-2/h3-8,18H,1-2H3,(H,19,20)
InChIKeyRKSMZQXOIAFJPO-UHFFFAOYSA-N
MW325.20 g/mol
LogP4.30
Rot. Bonds4

About 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide

5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide (PubChem CID 107623034) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide.

Molecular Properties

Compound Name5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
PubChem CID107623034
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)c(OC)c1
InChIInChI=1S/C15H14Cl2N2O2/c1-18-13-6-3-9(16)7-11(13)15(20)19-10-4-5-12(17)14(8-10)21-2/h3-8,18H,1-2H3,(H,19,20)
InChIKeyRKSMZQXOIAFJPO-UHFFFAOYSA-N
XLogP4.30
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide?
The IUPAC name of 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide (CID 107623034) is 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide.
What is the SMILES notation for 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide?
The canonical SMILES for 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide is CNc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)c(OC)c1.
What is the InChIKey of 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide?
The InChIKey is RKSMZQXOIAFJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-18-13-6-3-9(16)7-11(13)15(20)19-10-4-5-12(17)14(8-10)21-2/h3-8,18H,1-2H3,(H,19,20).
What are the key properties of 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide?
5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide has a molecular weight of 325.20 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide is sourced from PubChem (CID 107623034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).