3-N,5-N-dipropylpyridine-3,5-dicarboxamide

C13H19N3O2 — CID 47231705

IUPAC3-N,5-N-dipropylpyridine-3,5-dicarboxamide
SMILESCCCNC(=O)c1cncc(C(=O)NCCC)c1
InChIInChI=1S/C13H19N3O2/c1-3-5-15-12(17)10-7-11(9-14-8-10)13(18)16-6-4-2/h7-9H,3-6H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOAICFXCUHZXCOA-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.36
Rot. Bonds6

About 3-N,5-N-dipropylpyridine-3,5-dicarboxamide

3-N,5-N-dipropylpyridine-3,5-dicarboxamide (PubChem CID 47231705) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 3-N,5-N-dipropylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N,5-N-dipropylpyridine-3,5-dicarboxamide
PubChem CID47231705
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name3-N,5-N-dipropylpyridine-3,5-dicarboxamide
SMILESCCCNC(=O)c1cncc(C(=O)NCCC)c1
InChIInChI=1S/C13H19N3O2/c1-3-5-15-12(17)10-7-11(9-14-8-10)13(18)16-6-4-2/h7-9H,3-6H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyOAICFXCUHZXCOA-UHFFFAOYSA-N
XLogP1.36
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-[2-(dimethylamino)ethyl]-3-N-propylpyridine-3,5-dicarboxamide
CID 109101145
3-N-propyl-5-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109101238
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138
5-(butylamino)-N-propylpyridine-3-carboxamide
CID 109222762
5-N-(4-tert-butylphenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101242
5-N-(2-chlorophenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101245
5-(cyclopropylamino)-N-propylpyridine-3-carboxamide
CID 109222760
3-N-propyl-5-N-(2,3,4-trifluorophenyl)pyridine-3,5-dicarboxamide
CID 109101322
3-N-butyl-5-N-[3-(dimethylamino)propyl]pyridine-3,5-dicarboxamide
CID 109101925
5-(4-formylpiperazine-1-carbonyl)-N-propylpyridine-3-carboxamide
CID 109101150
5-N-methyl-3-N-propyl-5-N-(2-pyridin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109101177
5-(4-hydroxybut-1-ynyl)-N-propylpyridine-3-carboxamide
CID 54974842

Frequently Asked Questions

What is the IUPAC name of 3-N,5-N-dipropylpyridine-3,5-dicarboxamide?
The IUPAC name of 3-N,5-N-dipropylpyridine-3,5-dicarboxamide (CID 47231705) is 3-N,5-N-dipropylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N,5-N-dipropylpyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N,5-N-dipropylpyridine-3,5-dicarboxamide is CCCNC(=O)c1cncc(C(=O)NCCC)c1.
What is the InChIKey of 3-N,5-N-dipropylpyridine-3,5-dicarboxamide?
The InChIKey is OAICFXCUHZXCOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-5-15-12(17)10-7-11(9-14-8-10)13(18)16-6-4-2/h7-9H,3-6H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 3-N,5-N-dipropylpyridine-3,5-dicarboxamide?
3-N,5-N-dipropylpyridine-3,5-dicarboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,5-N-dipropylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 47231705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).