6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide

C20H25N3O2 — CID 109098987

IUPAC6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)Nc2ccc(C(C)C)cc2)n1
InChIInChI=1S/C20H25N3O2/c1-5-23(6-2)20(25)18-9-7-8-17(22-18)19(24)21-16-12-10-15(11-13-16)14(3)4/h7-14H,5-6H2,1-4H3,(H,21,24)
InChIKeyBRGCIQYXVKIJEX-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.94
Rot. Bonds6

About 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide

6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide (PubChem CID 109098987) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
PubChem CID109098987
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
SMILESCCN(CC)C(=O)c1cccc(C(=O)Nc2ccc(C(C)C)cc2)n1
InChIInChI=1S/C20H25N3O2/c1-5-23(6-2)20(25)18-9-7-8-17(22-18)19(24)21-16-12-10-15(11-13-16)14(3)4/h7-14H,5-6H2,1-4H3,(H,21,24)
InChIKeyBRGCIQYXVKIJEX-UHFFFAOYSA-N
XLogP3.94
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-benzyl-6-N-methyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109097697
2-N-(4-cyanophenyl)-6-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109100676
6-N-(3,4-difluorophenyl)-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109100678
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302
2-N-[(2-fluorophenyl)methyl]-6-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109097776
2-(diethylamino)-N-(4-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109310729
2-N-[4-(diethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099835
5-(diethylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109194751
2-N-(3-chloro-2-methylphenyl)-6-N,6-N-diethylpyridine-2,6-dicarboxamide
CID 109098998
2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099834
6-N-(4-chlorophenyl)-2-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094492
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 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide (CID 109098987) is 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide is CCN(CC)C(=O)c1cccc(C(=O)Nc2ccc(C(C)C)cc2)n1.
What is the InChIKey of 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
The InChIKey is BRGCIQYXVKIJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-5-23(6-2)20(25)18-9-7-8-17(22-18)19(24)21-16-12-10-15(11-13-16)14(3)4/h7-14H,5-6H2,1-4H3,(H,21,24).
What are the key properties of 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide?
6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N-diethyl-2-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109098987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).