2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide

C14H20N2O2 — CID 79458232

IUPAC2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COC2CCC(N)C2)cc1
InChIInChI=1S/C14H20N2O2/c1-10-2-5-12(6-3-10)16-14(17)9-18-13-7-4-11(15)8-13/h2-3,5-6,11,13H,4,7-9,15H2,1H3,(H,16,17)
InChIKeyMZGIGTURJVDAOY-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.83
Rot. Bonds4

About 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide

2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide (PubChem CID 79458232) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide
PubChem CID79458232
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COC2CCC(N)C2)cc1
InChIInChI=1S/C14H20N2O2/c1-10-2-5-12(6-3-10)16-14(17)9-18-13-7-4-11(15)8-13/h2-3,5-6,11,13H,4,7-9,15H2,1H3,(H,16,17)
InChIKeyMZGIGTURJVDAOY-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide (CID 79458232) is 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)COC2CCC(N)C2)cc1.
What is the InChIKey of 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide?
The InChIKey is MZGIGTURJVDAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-2-5-12(6-3-10)16-14(17)9-18-13-7-4-11(15)8-13/h2-3,5-6,11,13H,4,7-9,15H2,1H3,(H,16,17).
What are the key properties of 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide?
2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 79458232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).