N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide

C13H10Cl2N2O2 — CID 110864324

IUPACN-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C13H10Cl2N2O2/c1-19-13-8(4-3-7-16-13)12(18)17-11-9(14)5-2-6-10(11)15/h2-7H,1H3,(H,17,18)
InChIKeyAIYSTDWCFNJREK-UHFFFAOYSA-N
MW297.14 g/mol
LogP3.65
Rot. Bonds3

About N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide

N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide (PubChem CID 110864324) has the molecular formula C13H10Cl2N2O2 and a molecular weight of 297.14 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide
PubChem CID110864324
Molecular FormulaC13H10Cl2N2O2
Molecular Weight297.14 g/mol
Exact Mass296.01
IUPAC NameN-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C13H10Cl2N2O2/c1-19-13-8(4-3-7-16-13)12(18)17-11-9(14)5-2-6-10(11)15/h2-7H,1H3,(H,17,18)
InChIKeyAIYSTDWCFNJREK-UHFFFAOYSA-N
XLogP3.65
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.14
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide (CID 110864324) is N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide is COc1ncccc1C(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide?
The InChIKey is AIYSTDWCFNJREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O2/c1-19-13-8(4-3-7-16-13)12(18)17-11-9(14)5-2-6-10(11)15/h2-7H,1H3,(H,17,18).
What are the key properties of N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide?
N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide has a molecular weight of 297.14 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 110864324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).