2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide

C23H39N3O2 — CID 5210058

IUPAC2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide
SMILESCCCCC(CC)CNC(=O)c1cccc(C(=O)NCC(CC)CCCC)n1
InChIInChI=1S/C23H39N3O2/c1-5-9-12-18(7-3)16-24-22(27)20-14-11-15-21(26-20)23(28)25-17-19(8-4)13-10-6-2/h11,14-15,18-19H,5-10,12-13,16-17H2,1-4H3,(H,24,27)(H,25,28)
InChIKeySBAKTRPHOZTSJA-UHFFFAOYSA-N
MW389.58 g/mol
LogP4.97
Rot. Bonds14

About 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide

2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide (PubChem CID 5210058) has the molecular formula C23H39N3O2 and a molecular weight of 389.58 g/mol. Its IUPAC name is 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide
PubChem CID5210058
Molecular FormulaC23H39N3O2
Molecular Weight389.58 g/mol
Exact Mass389.30
IUPAC Name2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide
SMILESCCCCC(CC)CNC(=O)c1cccc(C(=O)NCC(CC)CCCC)n1
InChIInChI=1S/C23H39N3O2/c1-5-9-12-18(7-3)16-24-22(27)20-14-11-15-21(26-20)23(28)25-17-19(8-4)13-10-6-2/h11,14-15,18-19H,5-10,12-13,16-17H2,1-4H3,(H,24,27)(H,25,28)
InChIKeySBAKTRPHOZTSJA-UHFFFAOYSA-N
XLogP4.97
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.58
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethylbutyl)-6-methylpyridine-2-carboxamide
CID 115612957
N-(2-ethylhexyl)-2-hydroxybenzamide
CID 66524068
N-[(2R)-2-ethylhexyl]-2-naphthalen-1-ylacetamide
CID 7314092
N-[(2S)-2-ethylhexyl]pyridine-3-carboxamide
CID 2165504
N-(2-ethylhexyl)-6-(propylamino)pyridazine-3-carboxamide
CID 107818061
2-bromo-N-[(2S)-2-ethylhexyl]benzamide
CID 2287218
2-amino-N-(2-ethylhexyl)-6-methylbenzamide
CID 107819599
2-amino-N-(2-ethylhexyl)-3-methylbenzamide
CID 103604526
2-(1-amino-2-hydroxypropyl)-N-(2-ethylhexyl)-1,3-oxazole-4-carboxamide
CID 3844290
N-[(2S)-2-ethylhexyl]-4-iodobenzamide
CID 95356323
2-N,6-N-didecylpyridine-2,6-dicarboxamide
CID 4564479
N-(2-ethylhexyl)-2-(methylamino)benzamide
CID 61377678

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide (CID 5210058) is 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide is CCCCC(CC)CNC(=O)c1cccc(C(=O)NCC(CC)CCCC)n1.
What is the InChIKey of 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide?
The InChIKey is SBAKTRPHOZTSJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H39N3O2/c1-5-9-12-18(7-3)16-24-22(27)20-14-11-15-21(26-20)23(28)25-17-19(8-4)13-10-6-2/h11,14-15,18-19H,5-10,12-13,16-17H2,1-4H3,(H,24,27)(H,25,28).
What are the key properties of 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide?
2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide has a molecular weight of 389.58 g/mol, XLogP of 4.97, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis(2-ethylhexyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 5210058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).