2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide

C14H20N2O2 — CID 63277444

IUPAC2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide
SMILESCC1CCCC1NC(=O)COc1cccc(N)c1
InChIInChI=1S/C14H20N2O2/c1-10-4-2-7-13(10)16-14(17)9-18-12-6-3-5-11(15)8-12/h3,5-6,8,10,13H,2,4,7,9,15H2,1H3,(H,16,17)
InChIKeyBDCRXVFQORHVGB-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.95
Rot. Bonds4

About 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide

2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide (PubChem CID 63277444) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide
PubChem CID63277444
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide
SMILESCC1CCCC1NC(=O)COc1cccc(N)c1
InChIInChI=1S/C14H20N2O2/c1-10-4-2-7-13(10)16-14(17)9-18-12-6-3-5-11(15)8-12/h3,5-6,8,10,13H,2,4,7,9,15H2,1H3,(H,16,17)
InChIKeyBDCRXVFQORHVGB-UHFFFAOYSA-N
XLogP1.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.95
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

3-(3-aminophenoxy)-N-(2-methylcyclopentyl)propanamide
CID 55173195
2-(3-chlorophenoxy)-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 2632990
N-[(1R,2R)-2-methylcyclohexyl]-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 8024431
2-(3-aminophenoxy)-N-(4-methylcyclohexyl)acetamide
CID 54916003
N-[(1S,2S)-2-methylcyclohexyl]-2-naphthalen-2-yloxyacetamide
CID 2517702
N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2-(3-methylphenoxy)acetamide
CID 11920025
N-(2-methylcyclohexyl)-2-(3-nitrophenoxy)acetamide
CID 18077039
2-(3,5-dimethylphenoxy)-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 2712790
2-(3,5-dimethylphenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 2712787
2-(3-acetylphenoxy)-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]acetamide
CID 11917453
2-(3,4-difluorophenoxy)-N-[(1S,2R)-2-methylcyclohexyl]acetamide
CID 7707055
2-(3-aminophenoxy)-N-(2,2-dimethylcyclohexyl)acetamide
CID 79855622

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide?
The IUPAC name of 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide (CID 63277444) is 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide.
What is the SMILES notation for 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide?
The canonical SMILES for 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide is CC1CCCC1NC(=O)COc1cccc(N)c1.
What is the InChIKey of 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide?
The InChIKey is BDCRXVFQORHVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-4-2-7-13(10)16-14(17)9-18-12-6-3-5-11(15)8-12/h3,5-6,8,10,13H,2,4,7,9,15H2,1H3,(H,16,17).
What are the key properties of 2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide?
2-(3-aminophenoxy)-N-(2-methylcyclopentyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.95, 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-(2-methylcyclopentyl)acetamide is sourced from PubChem (CID 63277444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).