N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide

C20H20N4O2 — CID 109191680

IUPACN-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(NCc2ccncc2)cn1
InChIInChI=1S/C20H20N4O2/c1-2-26-19-6-4-3-5-17(19)24-20(25)18-8-7-16(14-23-18)22-13-15-9-11-21-12-10-15/h3-12,14,22H,2,13H2,1H3,(H,24,25)
InChIKeyNIWZQHUFJFHRQO-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.74
Rot. Bonds7

About N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide

N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide (PubChem CID 109191680) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
PubChem CID109191680
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(NCc2ccncc2)cn1
InChIInChI=1S/C20H20N4O2/c1-2-26-19-6-4-3-5-17(19)24-20(25)18-8-7-16(14-23-18)22-13-15-9-11-21-12-10-15/h3-12,14,22H,2,13H2,1H3,(H,24,25)
InChIKeyNIWZQHUFJFHRQO-UHFFFAOYSA-N
XLogP3.74
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-cyanophenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191731
N-(2-methoxyphenyl)-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191392
5-(benzylamino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109231887
6-(benzylamino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
CID 109117781
N-(2-ethoxyphenyl)-5-[(4-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281748
5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199969
N-(4-methoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191679
N'-(2-ethoxyphenyl)-N-(pyridin-4-ylmethyl)propanediamide
CID 108947846
4-N-(2-ethoxyphenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087665
N-(4-fluorophenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191663
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
N-(3,5-dimethylphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191648

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide (CID 109191680) is N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide is CCOc1ccccc1NC(=O)c1ccc(NCc2ccncc2)cn1.
What is the InChIKey of N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide?
The InChIKey is NIWZQHUFJFHRQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-2-26-19-6-4-3-5-17(19)24-20(25)18-8-7-16(14-23-18)22-13-15-9-11-21-12-10-15/h3-12,14,22H,2,13H2,1H3,(H,24,25).
What are the key properties of N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide?
N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 3.74, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109191680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).