2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide

C20H16Cl2N2O2 — CID 71150032

IUPAC2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide
SMILESCc1cc(-c2ccc(CNC(=O)c3c(Cl)cccc3Cl)cc2)cc(=O)[nH]1
InChIInChI=1S/C20H16Cl2N2O2/c1-12-9-15(10-18(25)24-12)14-7-5-13(6-8-14)11-23-20(26)19-16(21)3-2-4-17(19)22/h2-10H,11H2,1H3,(H,23,26)(H,24,25)
InChIKeyLWYWZWJVXJWUFS-UHFFFAOYSA-N
MW387.27 g/mol
LogP4.59
Rot. Bonds4

About 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide

2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide (PubChem CID 71150032) has the molecular formula C20H16Cl2N2O2 and a molecular weight of 387.27 g/mol. Its IUPAC name is 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide
PubChem CID71150032
Molecular FormulaC20H16Cl2N2O2
Molecular Weight387.27 g/mol
Exact Mass386.06
IUPAC Name2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide
SMILESCc1cc(-c2ccc(CNC(=O)c3c(Cl)cccc3Cl)cc2)cc(=O)[nH]1
InChIInChI=1S/C20H16Cl2N2O2/c1-12-9-15(10-18(25)24-12)14-7-5-13(6-8-14)11-23-20(26)19-16(21)3-2-4-17(19)22/h2-10H,11H2,1H3,(H,23,26)(H,24,25)
InChIKeyLWYWZWJVXJWUFS-UHFFFAOYSA-N
XLogP4.59
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.27
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide (CID 71150032) is 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide is Cc1cc(-c2ccc(CNC(=O)c3c(Cl)cccc3Cl)cc2)cc(=O)[nH]1.
What is the InChIKey of 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide?
The InChIKey is LWYWZWJVXJWUFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N2O2/c1-12-9-15(10-18(25)24-12)14-7-5-13(6-8-14)11-23-20(26)19-16(21)3-2-4-17(19)22/h2-10H,11H2,1H3,(H,23,26)(H,24,25).
What are the key properties of 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide?
2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide has a molecular weight of 387.27 g/mol, XLogP of 4.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[[4-(2-methyl-6-oxo-1H-pyridin-4-yl)phenyl]methyl]benzamide is sourced from PubChem (CID 71150032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).