N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide

C22H23N3O3 — CID 109192832

IUPACN-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
SMILESCOc1ccc(CCNc2ccc(C(=O)Nc3cccc(OC)c3)nc2)cc1
InChIInChI=1S/C22H23N3O3/c1-27-19-9-6-16(7-10-19)12-13-23-18-8-11-21(24-15-18)22(26)25-17-4-3-5-20(14-17)28-2/h3-11,14-15,23H,12-13H2,1-2H3,(H,25,26)
InChIKeySKNBUMDTXRHHQE-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.01
Rot. Bonds8

About N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide

N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide (PubChem CID 109192832) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
PubChem CID109192832
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
SMILESCOc1ccc(CCNc2ccc(C(=O)Nc3cccc(OC)c3)nc2)cc1
InChIInChI=1S/C22H23N3O3/c1-27-19-9-6-16(7-10-19)12-13-23-18-8-11-21(24-15-18)22(26)25-17-4-3-5-20(14-17)28-2/h3-11,14-15,23H,12-13H2,1-2H3,(H,25,26)
InChIKeySKNBUMDTXRHHQE-UHFFFAOYSA-N
XLogP4.01
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide (CID 109192832) is N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide is COc1ccc(CCNc2ccc(C(=O)Nc3cccc(OC)c3)nc2)cc1.
What is the InChIKey of N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The InChIKey is SKNBUMDTXRHHQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-27-19-9-6-16(7-10-19)12-13-23-18-8-11-21(24-15-18)22(26)25-17-4-3-5-20(14-17)28-2/h3-11,14-15,23H,12-13H2,1-2H3,(H,25,26).
What are the key properties of N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.01, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109192832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).