2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide

C15H22N2O2 — CID 63091712

IUPAC2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)COc1cccc2c1CCC2N
InChIInChI=1S/C15H22N2O2/c1-10(2)8-17-15(18)9-19-14-5-3-4-11-12(14)6-7-13(11)16/h3-5,10,13H,6-9,16H2,1-2H3,(H,17,18)
InChIKeyJSAFROBWWBITSW-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.78
Rot. Bonds5

About 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide

2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide (PubChem CID 63091712) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide
PubChem CID63091712
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)COc1cccc2c1CCC2N
InChIInChI=1S/C15H22N2O2/c1-10(2)8-17-15(18)9-19-14-5-3-4-11-12(14)6-7-13(11)16/h3-5,10,13H,6-9,16H2,1-2H3,(H,17,18)
InChIKeyJSAFROBWWBITSW-UHFFFAOYSA-N
XLogP1.78
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide (CID 63091712) is 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)COc1cccc2c1CCC2N.
What is the InChIKey of 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide?
The InChIKey is JSAFROBWWBITSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10(2)8-17-15(18)9-19-14-5-3-4-11-12(14)6-7-13(11)16/h3-5,10,13H,6-9,16H2,1-2H3,(H,17,18).
What are the key properties of 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide?
2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-amino-2,3-dihydro-1H-inden-4-yl)oxy]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 63091712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).