2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide

C22H24N4O2 — CID 142792386

IUPAC2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide
SMILESCCOc1ccccc1C(Cc1ccncc1)(NCc1cccnc1)C(N)=O
InChIInChI=1S/C22H24N4O2/c1-2-28-20-8-4-3-7-19(20)22(21(23)27,14-17-9-12-24-13-10-17)26-16-18-6-5-11-25-15-18/h3-13,15,26H,2,14,16H2,1H3,(H2,23,27)
InChIKeyICAWOYSXEUTUJQ-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.59
Rot. Bonds9

About 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide

2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide (PubChem CID 142792386) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide
PubChem CID142792386
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide
SMILESCCOc1ccccc1C(Cc1ccncc1)(NCc1cccnc1)C(N)=O
InChIInChI=1S/C22H24N4O2/c1-2-28-20-8-4-3-7-19(20)22(21(23)27,14-17-9-12-24-13-10-17)26-16-18-6-5-11-25-15-18/h3-13,15,26H,2,14,16H2,1H3,(H2,23,27)
InChIKeyICAWOYSXEUTUJQ-UHFFFAOYSA-N
XLogP2.59
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Tirbanibulin
CID 23635314
2-((2-ethylphenyl)methoxy)-N-(pyridin-3-yl)benzamide
CID 118911741
2-[5-[4-[2-[4-(2-cyclopropylethanoyl)piperazin-1-yl]ethoxy]phenyl]pyridin-2-yl]-N-(phenylmethyl)ethanamide
CID 155925939
(2S,4R)-N-tert-butyl-1-[(2R,3S)-3-[2-(2,6-dimethylphenoxy)acetamido]-2-hydroxy-4-phenylbutyl]-4-(pyridin-4-ylmethoxy)piperidine-2-carboxamide
CID 477521
N-(pyridin-4-yl)-9H-xanthene-9-carboxamide
CID 659939
Nalpha-[trans-4-(Aminomethyl)cyclohexane-1-Carbonyl]-N-Octyl-O-[(Pyridin-4-Yl)methyl]-L-Tyrosinamide
CID 10697355
N-[(3-methoxyphenyl)methyl]-5H-[1]benzopyrano[3,4-c]pyridine-8-carboxamide
CID 121363591
N-Methyl-N-((2-(1-(2-(methylamino)ethyl)piperidin-4-yl)pyridin-4-yl)methyl)-3-phenoxybenzamide
CID 122707126
2-Amino-3-methyl-2',7'-dipyridin-3-ylspiro[imidazole-5,9'-xanthene]-4-one
CID 53465113
N-[(1R)-1-(3-methoxyphenyl)ethyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
CID 86764444
Palinavir deriv. 10
CID 5327458
Palinavir deriv. 14
CID 5327461

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide?
The IUPAC name of 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide (CID 142792386) is 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide.
What is the SMILES notation for 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide?
The canonical SMILES for 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide is CCOc1ccccc1C(Cc1ccncc1)(NCc1cccnc1)C(N)=O.
What is the InChIKey of 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide?
The InChIKey is ICAWOYSXEUTUJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-2-28-20-8-4-3-7-19(20)22(21(23)27,14-17-9-12-24-13-10-17)26-16-18-6-5-11-25-15-18/h3-13,15,26H,2,14,16H2,1H3,(H2,23,27).
What are the key properties of 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide?
2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide has a molecular weight of 376.46 g/mol, XLogP of 2.59, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-3-pyridin-4-yl-2-(pyridin-3-ylmethylamino)propanamide is sourced from PubChem (CID 142792386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).