N-tert-butyl-2-(4-ethylphenoxy)acetamide

C14H21NO2 — CID 807221

IUPACN-tert-butyl-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-5-11-6-8-12(9-7-11)17-10-13(16)15-14(2,3)4/h6-9H,5,10H2,1-4H3,(H,15,16)
InChIKeyHNCAMMDXUMSIQX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.54
Rot. Bonds4

About N-tert-butyl-2-(4-ethylphenoxy)acetamide

N-tert-butyl-2-(4-ethylphenoxy)acetamide (PubChem CID 807221) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-tert-butyl-2-(4-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(4-ethylphenoxy)acetamide
PubChem CID807221
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-tert-butyl-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-5-11-6-8-12(9-7-11)17-10-13(16)15-14(2,3)4/h6-9H,5,10H2,1-4H3,(H,15,16)
InChIKeyHNCAMMDXUMSIQX-UHFFFAOYSA-N
XLogP2.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[2-(4-ethylphenoxy)acetyl]amino]-2-methylpropanoate
CID 30875979
N-(1-amino-2-methylpropan-2-yl)-2-(4-ethylphenoxy)acetamide
CID 82354507
methyl 2-[4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]acetate
CID 47096345
2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide
CID 54930613
N-tert-butyl-2-[4-[[3-(ethylamino)propylamino]methyl]phenoxy]acetamide
CID 17215562
N-tert-butyl-2-[4-[[3-(ethylamino)propylamino]methyl]phenoxy]acetamide;dihydrochloride
CID 17215561
2-(4-ethylphenoxy)-N-methoxyacetamide
CID 60716979
4-[[4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methylamino]benzoic acid
CID 66525531
N-tert-butyl-2-[4-[(4-fluoroanilino)methyl]phenoxy]acetamide
CID 66525538
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride
CID 119597780
1-N',6-N'-bis[2-(4-ethylphenoxy)acetyl]hexanedihydrazide
CID 3385883
2-(4-ethylphenoxy)-N-[2-(methylamino)-2-oxoethoxy]acetamide
CID 110495647

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(4-ethylphenoxy)acetamide?
The IUPAC name of N-tert-butyl-2-(4-ethylphenoxy)acetamide (CID 807221) is N-tert-butyl-2-(4-ethylphenoxy)acetamide.
What is the SMILES notation for N-tert-butyl-2-(4-ethylphenoxy)acetamide?
The canonical SMILES for N-tert-butyl-2-(4-ethylphenoxy)acetamide is CCc1ccc(OCC(=O)NC(C)(C)C)cc1.
What is the InChIKey of N-tert-butyl-2-(4-ethylphenoxy)acetamide?
The InChIKey is HNCAMMDXUMSIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-5-11-6-8-12(9-7-11)17-10-13(16)15-14(2,3)4/h6-9H,5,10H2,1-4H3,(H,15,16).
What are the key properties of N-tert-butyl-2-(4-ethylphenoxy)acetamide?
N-tert-butyl-2-(4-ethylphenoxy)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(4-ethylphenoxy)acetamide is sourced from PubChem (CID 807221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).