1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol

C15H24N2O — CID 43637052

IUPAC1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol
SMILESCN(C)C(C)(C)CNC1CCc2c(O)cccc21
InChIInChI=1S/C15H24N2O/c1-15(2,17(3)4)10-16-13-9-8-12-11(13)6-5-7-14(12)18/h5-7,13,16,18H,8-10H2,1-4H3
InChIKeyOWYHGQNPKLIUTO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.31
Rot. Bonds4

About 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol

1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol (PubChem CID 43637052) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol
PubChem CID43637052
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol
SMILESCN(C)C(C)(C)CNC1CCc2c(O)cccc21
InChIInChI=1S/C15H24N2O/c1-15(2,17(3)4)10-16-13-9-8-12-11(13)6-5-7-14(12)18/h5-7,13,16,18H,8-10H2,1-4H3
InChIKeyOWYHGQNPKLIUTO-UHFFFAOYSA-N
XLogP2.31
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol
CID 106145144
1-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-2,3-dihydro-1H-inden-4-ol
CID 43637090
1-(3-methylsulfinylpropylamino)-2,3-dihydro-1H-inden-4-ol
CID 113343184
1-(thian-4-ylmethylamino)-2,3-dihydro-1H-inden-4-ol
CID 115869693
1-(2-cyclohexylethylamino)-2,3-dihydro-1H-inden-4-ol
CID 54931966
N'-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 81302237
1-[(4-methyl-1,3-thiazol-2-yl)methylamino]-2,3-dihydro-1H-inden-4-ol
CID 54913172
1-[(1-methylcyclopentyl)methylamino]-2,3-dihydro-1H-inden-4-ol
CID 63822385
1-[(2-methylcyclopropyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 62397315
3-[(4-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]propanamide
CID 43637173
1-[(5-bromothiophen-2-yl)methylamino]-2,3-dihydro-1H-inden-4-ol
CID 54900064
methyl 3-[(4-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]propanoate
CID 43637145

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol (CID 43637052) is 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol is CN(C)C(C)(C)CNC1CCc2c(O)cccc21.
What is the InChIKey of 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol?
The InChIKey is OWYHGQNPKLIUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-15(2,17(3)4)10-16-13-9-8-12-11(13)6-5-7-14(12)18/h5-7,13,16,18H,8-10H2,1-4H3.
What are the key properties of 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol?
1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol has a molecular weight of 248.37 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(dimethylamino)-2-methylpropyl]amino]-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 43637052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).