3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide

C18H22N2O2 — CID 78805128

IUPAC3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCCOc1ccccc1CCC(=O)NCCc1ccccn1
InChIInChI=1S/C18H22N2O2/c1-2-22-17-9-4-3-7-15(17)10-11-18(21)20-14-12-16-8-5-6-13-19-16/h3-9,13H,2,10-12,14H2,1H3,(H,20,21)
InChIKeyRADXZZSAHPAIIN-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.77
Rot. Bonds8

About 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide

3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 78805128) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID78805128
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCCOc1ccccc1CCC(=O)NCCc1ccccn1
InChIInChI=1S/C18H22N2O2/c1-2-22-17-9-4-3-7-15(17)10-11-18(21)20-14-12-16-8-5-6-13-19-16/h3-9,13H,2,10-12,14H2,1H3,(H,20,21)
InChIKeyRADXZZSAHPAIIN-UHFFFAOYSA-N
XLogP2.77
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-hydroxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141809
3-[3-(2-ethoxyphenyl)propanoylamino]propanoic acid
CID 43170647
3-(2-ethoxyphenyl)-N-pentylpropanamide
CID 78805290
3-(2-ethoxyphenyl)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)propanamide
CID 31008355
3-(2-ethoxyphenyl)-N-(3-methoxypropyl)propanamide
CID 78805149
3-(2-ethoxyphenyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]propanamide
CID 32707909
2-[(2-ethoxyphenyl)methyl]-1-ethyl-3-(2-pyridin-2-ylethyl)guanidine
CID 111191566
methyl 2-[3-(2-ethoxyphenyl)propanoylamino]acetate
CID 43406380
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-(2-ethoxyphenyl)propanamide
CID 37218639
N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-ethoxyphenyl)propanamide
CID 51208011
4-amino-N-[2-(2-ethoxyphenyl)ethyl]butanamide;hydrochloride
CID 119317380
3-(2-ethoxyphenyl)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83029751

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide (CID 78805128) is 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide is CCOc1ccccc1CCC(=O)NCCc1ccccn1.
What is the InChIKey of 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is RADXZZSAHPAIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-2-22-17-9-4-3-7-15(17)10-11-18(21)20-14-12-16-8-5-6-13-19-16/h3-9,13H,2,10-12,14H2,1H3,(H,20,21).
What are the key properties of 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide?
3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 298.39 g/mol, XLogP of 2.77, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenyl)-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 78805128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).