N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide

C17H20N4O3 — CID 109205974

IUPACN-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
SMILESCOCCNc1ccnc(C(=O)Nc2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C17H20N4O3/c1-12(22)20-13-3-5-14(6-4-13)21-17(23)16-11-15(7-8-19-16)18-9-10-24-2/h3-8,11H,9-10H2,1-2H3,(H,18,19)(H,20,22)(H,21,23)
InChIKeyDVZZVYNNTHSWGL-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.35
Rot. Bonds7

About N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide

N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide (PubChem CID 109205974) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
PubChem CID109205974
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
SMILESCOCCNc1ccnc(C(=O)Nc2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C17H20N4O3/c1-12(22)20-13-3-5-14(6-4-13)21-17(23)16-11-15(7-8-19-16)18-9-10-24-2/h3-8,11H,9-10H2,1-2H3,(H,18,19)(H,20,22)(H,21,23)
InChIKeyDVZZVYNNTHSWGL-UHFFFAOYSA-N
XLogP2.35
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methoxyethylamino)-N-(4-phenylmethoxyphenyl)pyridine-2-carboxamide
CID 109205989
N-(4-bromophenyl)-4-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109206317
N-(2,4-dichlorophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109206008
N-(3,4-difluorophenyl)-4-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109206385
N-(4-acetylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201249
N-(2,4-dimethoxyphenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109205966
N-(2-chloro-4,6-dimethylphenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109205952
methyl 4-[2-(2-methoxyethylamino)ethylamino]pyridine-2-carboxylate
CID 83029565
4-(3-methylbutylamino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109217395
4-(propylamino)-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109201247
N-(4-chlorophenyl)-4-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109207365
N-(3,4-dimethylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62173356

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide (CID 109205974) is N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide is COCCNc1ccnc(C(=O)Nc2ccc(NC(C)=O)cc2)c1.
What is the InChIKey of N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide?
The InChIKey is DVZZVYNNTHSWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-12(22)20-13-3-5-14(6-4-13)21-17(23)16-11-15(7-8-19-16)18-9-10-24-2/h3-8,11H,9-10H2,1-2H3,(H,18,19)(H,20,22)(H,21,23).
What are the key properties of N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide?
N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 2.35, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109205974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).