2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide

C14H21NO2 — CID 1120997

IUPAC2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-4-12-5-7-13(8-6-12)17-10-14(16)15-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,15,16)
InChIKeyQQTWUHYSASGICG-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.40
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide

2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide (PubChem CID 1120997) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
PubChem CID1120997
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
SMILESCCc1ccc(OCC(=O)NCC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-4-12-5-7-13(8-6-12)17-10-14(16)15-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,15,16)
InChIKeyQQTWUHYSASGICG-UHFFFAOYSA-N
XLogP2.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-2-methylpropyl)-2-(4-ethylphenoxy)acetamide
CID 119996402
2-[4-(2-aminoethyl)phenoxy]-N-(2-methylpropyl)acetamide
CID 16773407
N-(2-methylpropyl)-2-[4-(2-oxopropyl)phenoxy]acetamide
CID 113323047
2-[4-(3-methyl-2-oxobutoxy)phenoxy]-N-(2-methylpropyl)acetamide
CID 23405136
2-[4-(3-aminobutyl)phenoxy]-N-(2-methylpropyl)acetamide
CID 16783381
N-(3,3-difluoro-2-hydroxypropyl)-2-(4-ethylphenoxy)acetamide
CID 103770190
3-[[[2-(4-ethylphenoxy)acetyl]amino]methyl]pentanoic acid
CID 81065749
2-[4-(1-aminoethyl)phenoxy]-N-(2-methylpropyl)acetamide
CID 16794372
2-[4-(4-methylphenoxy)phenoxy]-N-(2-methylpropyl)acetamide
CID 23732384
2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 94124569
N-[2-(diethylamino)-2-phenylethyl]-2-(4-ethylphenoxy)acetamide
CID 45155375
N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-2-(4-ethylphenoxy)acetamide
CID 16931216

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide (CID 1120997) is 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide is CCc1ccc(OCC(=O)NCC(C)C)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide?
The InChIKey is QQTWUHYSASGICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-12-5-7-13(8-6-12)17-10-14(16)15-9-11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H,15,16).
What are the key properties of 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide?
2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 1120997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).