2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide

C16H24N2O2 — CID 61466103

IUPAC2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)COc2ccc(N)cc2)CC1
InChIInChI=1S/C16H24N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h5-6,9-10,12,14H,2-4,7-8,11,17H2,1H3,(H,18,19)
InChIKeyXNUCCMVHNDGOIM-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.73
Rot. Bonds5

About 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide

2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide (PubChem CID 61466103) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
PubChem CID61466103
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
SMILESCCC1CCC(NC(=O)COc2ccc(N)cc2)CC1
InChIInChI=1S/C16H24N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h5-6,9-10,12,14H,2-4,7-8,11,17H2,1H3,(H,18,19)
InChIKeyXNUCCMVHNDGOIM-UHFFFAOYSA-N
XLogP2.73
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminophenoxy)-N-(cyclopropylcarbamoyl)acetamide
CID 54908932
2-(4-aminophenoxy)-N-(1,1-dioxothian-4-yl)acetamide
CID 61102889
3-[[2-(4-aminophenoxy)acetyl]amino]-N-cyclopropylpropanamide
CID 79385591
N-(4-aminocyclohexyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
CID 119474575
2-(4-aminophenoxy)-N-[(1R,3R)-3-methylcyclohexyl]acetamide
CID 28689734
N-(4-aminocyclohexyl)-2-(4-methylphenoxy)acetamide;hydrochloride
CID 119474987
2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide
CID 61026518
2-(4-aminophenoxy)-N-(oxan-3-yl)acetamide
CID 55190193
2-(4-aminophenoxy)-N-(1-methyl-6-oxopiperidin-3-yl)acetamide
CID 64654058
N-(4-hydroxycyclohexyl)-2-(4-propoxyphenoxy)acetamide
CID 78767377
2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide
CID 54916003
2-[4-(aminomethyl)phenoxy]-N-(4-methylcyclohexyl)acetamide
CID 16796047

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide?
The IUPAC name of 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide (CID 61466103) is 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide.
What is the SMILES notation for 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide?
The canonical SMILES for 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide is CCC1CCC(NC(=O)COc2ccc(N)cc2)CC1.
What is the InChIKey of 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide?
The InChIKey is XNUCCMVHNDGOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-2-12-3-7-14(8-4-12)18-16(19)11-20-15-9-5-13(17)6-10-15/h5-6,9-10,12,14H,2-4,7-8,11,17H2,1H3,(H,18,19).
What are the key properties of 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide?
2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide is sourced from PubChem (CID 61466103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).