2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide

C18H20ClN3O2 — CID 109098998

IUPAC2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)Nc2cccc(Cl)c2C)n1
InChIInChI=1S/C18H20ClN3O2/c1-4-22(5-2)18(24)16-11-7-10-15(20-16)17(23)21-14-9-6-8-13(19)12(14)3/h6-11H,4-5H2,1-3H3,(H,21,23)
InChIKeyFPTFUCFRIKYSMP-UHFFFAOYSA-N
MW345.83 g/mol
LogP3.78
Rot. Bonds5

About 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide

2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide (PubChem CID 109098998) has the molecular formula C18H20ClN3O2 and a molecular weight of 345.83 g/mol. Its IUPAC name is 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide
PubChem CID109098998
Molecular FormulaC18H20ClN3O2
Molecular Weight345.83 g/mol
Exact Mass345.12
IUPAC Name2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)Nc2cccc(Cl)c2C)n1
InChIInChI=1S/C18H20ClN3O2/c1-4-22(5-2)18(24)16-11-7-10-15(20-16)17(23)21-14-9-6-8-13(19)12(14)3/h6-11H,4-5H2,1-3H3,(H,21,23)
InChIKeyFPTFUCFRIKYSMP-UHFFFAOYSA-N
XLogP3.78
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.83
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(3-chloro-2-methylphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100060
N-(3-chloro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 31759188
6-bromo-N-(3-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 103874055
6-N-(3-chloro-2-methylphenyl)-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097382
6-N-(3-chloro-2-methylphenyl)-2-N-(2-phenylethyl)pyridine-2,6-dicarboxamide
CID 109098456
6-N,6-N-diethyl-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109099049
1-N-(3-chloro-2-methylphenyl)-3-N,3-N-diethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109076721
6-(3-chloro-2-methylanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124439
methyl 4-chloro-3-[[6-(diethylcarbamoyl)pyridine-2-carbonyl]amino]benzoate
CID 109099029
6-N-(3-chloro-2-methylphenyl)-2-N-(4-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100872
N-(3-chloro-2-methylphenyl)-N',N'-diethylpropanediamide
CID 108951094
6-N,6-N-diethyl-2-N-(2,4,6-trimethylphenyl)pyridine-2,6-dicarboxamide
CID 109098988

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide (CID 109098998) is 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide is CCN(CC)C(=O)c1cccc(C(=O)Nc2cccc(Cl)c2C)n1.
What is the InChIKey of 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide?
The InChIKey is FPTFUCFRIKYSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN3O2/c1-4-22(5-2)18(24)16-11-7-10-15(20-16)17(23)21-14-9-6-8-13(19)12(14)3/h6-11H,4-5H2,1-3H3,(H,21,23).
What are the key properties of 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide?
2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide has a molecular weight of 345.83 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109098998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).