3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide

C17H20N2O2 — CID 108795745

IUPAC3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
SMILESCCc1ccc(OCCC(=O)NCc2cccnc2)cc1
InChIInChI=1S/C17H20N2O2/c1-2-14-5-7-16(8-6-14)21-11-9-17(20)19-13-15-4-3-10-18-12-15/h3-8,10,12H,2,9,11,13H2,1H3,(H,19,20)
InChIKeySBNUGOWVFILCFH-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.73
Rot. Bonds7

About 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide

3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 108795745) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
PubChem CID108795745
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
SMILESCCc1ccc(OCCC(=O)NCc2cccnc2)cc1
InChIInChI=1S/C17H20N2O2/c1-2-14-5-7-16(8-6-14)21-11-9-17(20)19-13-15-4-3-10-18-12-15/h3-8,10,12H,2,9,11,13H2,1H3,(H,19,20)
InChIKeySBNUGOWVFILCFH-UHFFFAOYSA-N
XLogP2.73
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-oxo-4-(4-propoxyphenyl)-N-(pyridin-3-ylmethyl)butanamide
CID 29175980
3-methoxy-N-(pyridin-3-ylmethyl)propanamide
CID 110839174
3-(3-bromophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 51155626
3-(N-acetyl-4-ethylanilino)-N-(pyridin-3-ylmethyl)propanamide
CID 113125365
N'-(4-ethoxyphenyl)-N-(pyridin-3-ylmethyl)propanediamide
CID 108947690
N-[(4-methoxyphenyl)methyl]-3-phenoxypropanamide
CID 26365331
4-ethoxy-N-(pyridin-3-ylmethyl)benzamide
CID 673607
3-(3,4-diethoxyphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 38019578
3-(4-methoxyphenoxy)-N-(pyridin-4-ylmethyl)propanamide
CID 110678375
N-[(4-ethylphenyl)methyl]-3-(4-fluorophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 55595750
N-benzyl-3-(4-methoxyphenoxy)propanamide
CID 974838
3-[4-(difluoromethoxy)phenyl]-N-(pyridin-3-ylmethyl)propanamide
CID 35556031

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide (CID 108795745) is 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide is CCc1ccc(OCCC(=O)NCc2cccnc2)cc1.
What is the InChIKey of 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is SBNUGOWVFILCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-2-14-5-7-16(8-6-14)21-11-9-17(20)19-13-15-4-3-10-18-12-15/h3-8,10,12H,2,9,11,13H2,1H3,(H,19,20).
What are the key properties of 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 284.36 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenoxy)-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 108795745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).