6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide

C20H25N3O2 — CID 109093496

IUPAC6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide
SMILESCCCNC(=O)c1cccc(C(=O)N(Cc2ccccc2)C(C)C)n1
InChIInChI=1S/C20H25N3O2/c1-4-13-21-19(24)17-11-8-12-18(22-17)20(25)23(15(2)3)14-16-9-6-5-7-10-16/h5-12,15H,4,13-14H2,1-3H3,(H,21,24)
InChIKeySGCLRZWYHSZLJQ-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.27
Rot. Bonds7

About 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide

6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide (PubChem CID 109093496) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide
PubChem CID109093496
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide
SMILESCCCNC(=O)c1cccc(C(=O)N(Cc2ccccc2)C(C)C)n1
InChIInChI=1S/C20H25N3O2/c1-4-13-21-19(24)17-11-8-12-18(22-17)20(25)23(15(2)3)14-16-9-6-5-7-10-16/h5-12,15H,4,13-14H2,1-3H3,(H,21,24)
InChIKeySGCLRZWYHSZLJQ-UHFFFAOYSA-N
XLogP3.27
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-benzyl-6-N-ethyl-2-N-propylpyridine-2,6-dicarboxamide
CID 109093457
6-N-benzyl-2-N-(furan-2-ylmethyl)-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109097118
6-N-benzyl-2-N-butyl-2-N-methyl-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109099313
2-[benzyl(propan-2-yl)amino]-N-propylpyrimidine-4-carboxamide
CID 109294999
6-N-benzyl-2-N-(3-fluorophenyl)-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109099326
N-benzyl-N-propan-2-ylpyridine-2-carboxamide
CID 42778097
N-propyl-6-[6-(propylcarbamoyl)-2-pyridinyl]pyridine-2-carboxamide
CID 10980324
N-benzyl-5-(dipropylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109195430
6-N-benzyl-2-N-[3-(dimethylamino)propyl]-6-N-ethylpyridine-2,6-dicarboxamide
CID 109096524
2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094402
2-N-propyl-6-N-(pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109093458
1-benzyl-3-ethyl-1-propan-2-ylurea
CID 108890429

Frequently Asked Questions

What is the IUPAC name of 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide (CID 109093496) is 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide is CCCNC(=O)c1cccc(C(=O)N(Cc2ccccc2)C(C)C)n1.
What is the InChIKey of 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide?
The InChIKey is SGCLRZWYHSZLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-4-13-21-19(24)17-11-8-12-18(22-17)20(25)23(15(2)3)14-16-9-6-5-7-10-16/h5-12,15H,4,13-14H2,1-3H3,(H,21,24).
What are the key properties of 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide?
6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-benzyl-6-N-propan-2-yl-2-N-propylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109093496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).