N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide

C19H31NO2 — CID 133235259

IUPACN-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide
SMILESCCCCC(CC)CNC(=O)C(C)Oc1ccccc1CC
InChIInChI=1S/C19H31NO2/c1-5-8-11-16(6-2)14-20-19(21)15(4)22-18-13-10-9-12-17(18)7-3/h9-10,12-13,15-16H,5-8,11,14H2,1-4H3,(H,20,21)
InChIKeyAVBGSJMGGPNJBI-UHFFFAOYSA-N
MW305.46 g/mol
LogP4.35
Rot. Bonds10

About N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide

N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide (PubChem CID 133235259) has the molecular formula C19H31NO2 and a molecular weight of 305.46 g/mol. Its IUPAC name is N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide
PubChem CID133235259
Molecular FormulaC19H31NO2
Molecular Weight305.46 g/mol
Exact Mass305.24
IUPAC NameN-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide
SMILESCCCCC(CC)CNC(=O)C(C)Oc1ccccc1CC
InChIInChI=1S/C19H31NO2/c1-5-8-11-16(6-2)14-20-19(21)15(4)22-18-13-10-9-12-17(18)7-3/h9-10,12-13,15-16H,5-8,11,14H2,1-4H3,(H,20,21)
InChIKeyAVBGSJMGGPNJBI-UHFFFAOYSA-N
XLogP4.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.46
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-[(2S)-2-ethylhexyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 100546024
(2S)-2-(2,4-dibromophenoxy)-N-[(2R)-2-ethylhexyl]propanamide
CID 40736866
(2R)-N-[(2S)-2-ethylhexyl]-2-phenoxybutanamide
CID 2165377
(2R)-2-(2-ethylphenoxy)-N-[(2S)-pentan-2-yl]propanamide
CID 92684665
(2S)-2-(2-ethylphenoxy)-N-[(2R)-pentan-2-yl]propanamide
CID 92684666
2-[2-[1-oxo-1-(pentylamino)propan-2-yl]oxyphenyl]acetic acid
CID 80722346
(2S)-2-(2-ethylphenoxy)-N-methylpropanamide
CID 28577058
2-(2-ethylphenoxy)-N-(2-methoxyethyl)propanamide
CID 53284936
(2S)-2-(2-ethylphenoxy)-N-(3-propan-2-yloxypropyl)propanamide
CID 99959864
(2S)-2-(2-ethylphenoxy)-N-(3-phenylpropyl)propanamide
CID 92685651
N-(2,4-dimethylpentan-3-yl)-2-(2-ethylphenoxy)propanamide
CID 53285104
(2R)-2-(2-ethylphenoxy)-N-[(2S)-3-methylbutan-2-yl]propanamide
CID 100568779

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide?
The IUPAC name of N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide (CID 133235259) is N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide.
What is the SMILES notation for N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide?
The canonical SMILES for N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide is CCCCC(CC)CNC(=O)C(C)Oc1ccccc1CC.
What is the InChIKey of N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide?
The InChIKey is AVBGSJMGGPNJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO2/c1-5-8-11-16(6-2)14-20-19(21)15(4)22-18-13-10-9-12-17(18)7-3/h9-10,12-13,15-16H,5-8,11,14H2,1-4H3,(H,20,21).
What are the key properties of N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide?
N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide has a molecular weight of 305.46 g/mol, XLogP of 4.35, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylhexyl)-2-(2-ethylphenoxy)propanamide is sourced from PubChem (CID 133235259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).