5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide

C19H25N3O3 — CID 109228037

IUPAC5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
SMILESCOCCCNC(=O)c1cncc(NCCc2ccccc2OC)c1
InChIInChI=1S/C19H25N3O3/c1-24-11-5-9-22-19(23)16-12-17(14-20-13-16)21-10-8-15-6-3-4-7-18(15)25-2/h3-4,6-7,12-14,21H,5,8-11H2,1-2H3,(H,22,23)
InChIKeyYTOGRPOHBMUPMW-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.51
Rot. Bonds10

About 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide

5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide (PubChem CID 109228037) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
PubChem CID109228037
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
SMILESCOCCCNC(=O)c1cncc(NCCc2ccccc2OC)c1
InChIInChI=1S/C19H25N3O3/c1-24-11-5-9-22-19(23)16-12-17(14-20-13-16)21-10-8-15-6-3-4-7-18(15)25-2/h3-4,6-7,12-14,21H,5,8-11H2,1-2H3,(H,22,23)
InChIKeyYTOGRPOHBMUPMW-UHFFFAOYSA-N
XLogP2.51
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.51
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

5-[2-(2-methoxyphenyl)ethylamino]-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109236652
5-[(2-fluorophenyl)methylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228022
5-[2-(2-methoxyphenyl)ethylamino]-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109235494
5-[2-(3-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228038
5-(butylamino)-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109224564
5-[2-(2-methoxyphenyl)ethylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229476
N-[(2-methoxyphenyl)methyl]-5-(propylamino)pyridine-3-carboxamide
CID 109222992
N-(2-methoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228300
N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide
CID 109228070
N-(2-ethyl-6-methylphenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236678
N-[2-(4-fluorophenyl)ethyl]-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228217
N-[2-(1H-indol-3-yl)ethyl]-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228227

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide?
The IUPAC name of 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide (CID 109228037) is 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide is COCCCNC(=O)c1cncc(NCCc2ccccc2OC)c1.
What is the InChIKey of 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide?
The InChIKey is YTOGRPOHBMUPMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-24-11-5-9-22-19(23)16-12-17(14-20-13-16)21-10-8-15-6-3-4-7-18(15)25-2/h3-4,6-7,12-14,21H,5,8-11H2,1-2H3,(H,22,23).
What are the key properties of 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide?
5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.51, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide is sourced from PubChem (CID 109228037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).