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

C17H26N2O2 — CID 63089777

IUPAC2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide
SMILESCNC1CCc2c(OC(C)C(=O)NCC(C)C)cccc21
InChIInChI=1S/C17H26N2O2/c1-11(2)10-19-17(20)12(3)21-16-7-5-6-13-14(16)8-9-15(13)18-4/h5-7,11-12,15,18H,8-10H2,1-4H3,(H,19,20)
InChIKeyFCDZGKBZTUULKN-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.43
Rot. Bonds6

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

2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide (PubChem CID 63089777) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide
PubChem CID63089777
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide
SMILESCNC1CCc2c(OC(C)C(=O)NCC(C)C)cccc21
InChIInChI=1S/C17H26N2O2/c1-11(2)10-19-17(20)12(3)21-16-7-5-6-13-14(16)8-9-15(13)18-4/h5-7,11-12,15,18H,8-10H2,1-4H3,(H,19,20)
InChIKeyFCDZGKBZTUULKN-UHFFFAOYSA-N
XLogP2.43
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide (CID 63089777) is 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide is CNC1CCc2c(OC(C)C(=O)NCC(C)C)cccc21.
What is the InChIKey of 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide?
The InChIKey is FCDZGKBZTUULKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-11(2)10-19-17(20)12(3)21-16-7-5-6-13-14(16)8-9-15(13)18-4/h5-7,11-12,15,18H,8-10H2,1-4H3,(H,19,20).
What are the key properties of 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide?
2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(methylamino)-2,3-dihydro-1H-inden-4-yl]oxy]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 63089777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).