N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide

C17H21N3O3 — CID 109228300

IUPACN-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
SMILESCOCCCNc1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C17H21N3O3/c1-22-9-5-8-19-14-10-13(11-18-12-14)17(21)20-15-6-3-4-7-16(15)23-2/h3-4,6-7,10-12,19H,5,8-9H2,1-2H3,(H,20,21)
InChIKeyASUKZOHQKBFATH-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.79
Rot. Bonds8

About N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide

N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide (PubChem CID 109228300) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
PubChem CID109228300
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC NameN-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
SMILESCOCCCNc1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C17H21N3O3/c1-22-9-5-8-19-14-10-13(11-18-12-14)17(21)20-15-6-3-4-7-16(15)23-2/h3-4,6-7,10-12,19H,5,8-9H2,1-2H3,(H,20,21)
InChIKeyASUKZOHQKBFATH-UHFFFAOYSA-N
XLogP2.79
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-dimethoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228308
5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228037
5-(3-methoxypropylamino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109228264
5-N-(2-methoxyphenyl)-3-N-phenylpyridine-3,5-dicarboxamide
CID 109107789
5-(butylamino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109224665
N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
CID 109240183
N-(4-bromo-2-methylphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228337
5-[3-(dimethylamino)propylamino]-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109230003
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2-methoxyphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242131
5-[2-(2-methoxyphenyl)ethylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109236679
N-(2-propan-2-yloxyphenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223094

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide (CID 109228300) is N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide is COCCCNc1cncc(C(=O)Nc2ccccc2OC)c1.
What is the InChIKey of N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide?
The InChIKey is ASUKZOHQKBFATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-22-9-5-8-19-14-10-13(11-18-12-14)17(21)20-15-6-3-4-7-16(15)23-2/h3-4,6-7,10-12,19H,5,8-9H2,1-2H3,(H,20,21).
What are the key properties of N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide?
N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide has a molecular weight of 315.37 g/mol, XLogP of 2.79, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109228300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).