2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide

C15H22N2O2 — CID 54916003

IUPAC2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)COc2cccc(N)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-11-5-7-13(8-6-11)17-15(18)10-19-14-4-2-3-12(16)9-14/h2-4,9,11,13H,5-8,10,16H2,1H3,(H,17,18)
InChIKeyRTKZWAPNSHWJPW-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.34
Rot. Bonds4

About 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide

2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide (PubChem CID 54916003) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide
PubChem CID54916003
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide
SMILESCC1CCC(NC(=O)COc2cccc(N)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-11-5-7-13(8-6-11)17-15(18)10-19-14-4-2-3-12(16)9-14/h2-4,9,11,13H,5-8,10,16H2,1H3,(H,17,18)
InChIKeyRTKZWAPNSHWJPW-UHFFFAOYSA-N
XLogP2.34
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

methyl N-[3-[2-[(4-methylcyclohexyl)amino]-2-oxoethoxy]phenyl]carbamate
CID 75532248
4-[[2-(3-aminophenoxy)acetyl]amino]-N-cyclopropylbutanamide
CID 79378028
2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide
CID 63277444
2-[4-(aminomethyl)phenoxy]-N-(4-methylcyclohexyl)acetamide
CID 16796047
2-[3-(1-aminoethyl)phenoxy]-N-cyclopropylacetamide
CID 16783350
[1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(3-aminophenoxy)acetate
CID 61321535
N-(4-hydroxycyclohexyl)-2-(3-methylphenoxy)acetamide
CID 17453727
2-(3-aminophenoxy)-N-(2,2-dimethylcyclohexyl)acetamide
CID 79855622
2-[3-(2-aminoethyl)phenoxy]-N-cyclopropylacetamide
CID 54930762
3-(3-aminophenoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
CID 61093289
N-(3-methylcyclopentyl)-2-(3-nitrophenoxy)acetamide
CID 114549924
2-(4-aminophenoxy)-N-(4-ethylcyclohexyl)acetamide
CID 61466103

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide (CID 54916003) is 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide is CC1CCC(NC(=O)COc2cccc(N)c2)CC1.
What is the InChIKey of 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide?
The InChIKey is RTKZWAPNSHWJPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-5-7-13(8-6-11)17-15(18)10-19-14-4-2-3-12(16)9-14/h2-4,9,11,13H,5-8,10,16H2,1H3,(H,17,18).
What are the key properties of 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide?
2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 54916003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).