5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide

C19H23N3O3 — CID 109103413

IUPAC5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cncc(C(=O)NCCOC)c1
InChIInChI=1S/C19H23N3O3/c1-3-22(14-15-7-5-4-6-8-15)19(24)17-11-16(12-20-13-17)18(23)21-9-10-25-2/h4-8,11-13H,3,9-10,14H2,1-2H3,(H,21,23)
InChIKeyNXAFPAMORWYLPH-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.12
Rot. Bonds8

About 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide

5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide (PubChem CID 109103413) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
PubChem CID109103413
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cncc(C(=O)NCCOC)c1
InChIInChI=1S/C19H23N3O3/c1-3-22(14-15-7-5-4-6-8-15)19(24)17-11-16(12-20-13-17)18(23)21-9-10-25-2/h4-8,11-13H,3,9-10,14H2,1-2H3,(H,21,23)
InChIKeyNXAFPAMORWYLPH-UHFFFAOYSA-N
XLogP2.12
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-N-benzyl-5-N-ethyl-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105843
5-N-benzyl-5-N-ethyl-3-N-[(4-methylphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105262
5-N-benzyl-3-N-(2,5-dimethylphenyl)-5-N-ethylpyridine-3,5-dicarboxamide
CID 109105863
3-N-benzyl-3-N-ethyl-1-N-propylbenzene-1,3-dicarboxamide
CID 109050312
3-N-[2-(3-chlorophenyl)ethyl]-5-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
CID 109103459
5-anilino-N-(2-methoxyethyl)pyridine-3-carboxamide
CID 109227713
N-benzyl-5-(4-tert-butylanilino)-N-ethylpyridine-3-carboxamide
CID 109234765
N-benzyl-5-(3,4-difluoroanilino)-N-ethylpyridine-3-carboxamide
CID 109234812
3-N-benzyl-1-N-(2-methoxyethyl)-3-N-methylbenzene-1,3-dicarboxamide
CID 109052503
3-N-[2-(4-chlorophenyl)ethyl]-5-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide
CID 109103432
3-N-(3-methoxypropyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109103626
5-N-butyl-3-N-(2-methoxyethyl)-5-N-methylpyridine-3,5-dicarboxamide
CID 109103454

Frequently Asked Questions

What is the IUPAC name of 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide (CID 109103413) is 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide is CCN(Cc1ccccc1)C(=O)c1cncc(C(=O)NCCOC)c1.
What is the InChIKey of 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide?
The InChIKey is NXAFPAMORWYLPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-22(14-15-7-5-4-6-8-15)19(24)17-11-16(12-20-13-17)18(23)21-9-10-25-2/h4-8,11-13H,3,9-10,14H2,1-2H3,(H,21,23).
What are the key properties of 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide?
5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.12, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-benzyl-5-N-ethyl-3-N-(2-methoxyethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109103413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).