2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide

C19H23N3O2 — CID 109089263

IUPAC2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2ccnc(C(=O)NC(C)(C)C)c2)c1C
InChIInChI=1S/C19H23N3O2/c1-12-7-6-8-15(13(12)2)21-17(23)14-9-10-20-16(11-14)18(24)22-19(3,4)5/h6-11H,1-5H3,(H,21,23)(H,22,24)
InChIKeyRZJGGUDMFVPTOL-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.48
Rot. Bonds3

About 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide

2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109089263) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109089263
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2ccnc(C(=O)NC(C)(C)C)c2)c1C
InChIInChI=1S/C19H23N3O2/c1-12-7-6-8-15(13(12)2)21-17(23)14-9-10-20-16(11-14)18(24)22-19(3,4)5/h6-11H,1-5H3,(H,21,23)(H,22,24)
InChIKeyRZJGGUDMFVPTOL-UHFFFAOYSA-N
XLogP3.48
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092030
4-N-tert-butyl-2-N-(3-chloro-2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089161
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
4-N-(2,3-dimethylphenyl)-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092107
2-N-tert-butyl-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109089264
2-N-(2,3-dimethylphenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092159
4-N-(2-bromo-4-methylphenyl)-2-N-tert-butylpyridine-2,4-dicarboxamide
CID 109089325
4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109089379
2-N-(3-chloro-4-fluorophenyl)-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092121
4-N-tert-butyl-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109089156
4-N-(3-acetylphenyl)-2-N-tert-butylpyridine-2,4-dicarboxamide
CID 109089304
N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
CID 110857659

Frequently Asked Questions

What is the IUPAC name of 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide (CID 109089263) is 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide is Cc1cccc(NC(=O)c2ccnc(C(=O)NC(C)(C)C)c2)c1C.
What is the InChIKey of 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is RZJGGUDMFVPTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-12-7-6-8-15(13(12)2)21-17(23)14-9-10-20-16(11-14)18(24)22-19(3,4)5/h6-11H,1-5H3,(H,21,23)(H,22,24).
What are the key properties of 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide?
2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 325.41 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-tert-butyl-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109089263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).