1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol

C15H21NO2 — CID 107682224

IUPAC1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CCC2NCCC1CCCO1
InChIInChI=1S/C15H21NO2/c17-12-4-5-14-11(10-12)3-6-15(14)16-8-7-13-2-1-9-18-13/h4-5,10,13,15-17H,1-3,6-9H2
InChIKeyJRQVPYJTFPKBPZ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.54
Rot. Bonds4

About 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol

1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol (PubChem CID 107682224) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
PubChem CID107682224
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CCC2NCCC1CCCO1
InChIInChI=1S/C15H21NO2/c17-12-4-5-14-11(10-12)3-6-15(14)16-8-7-13-2-1-9-18-13/h4-5,10,13,15-17H,1-3,6-9H2
InChIKeyJRQVPYJTFPKBPZ-UHFFFAOYSA-N
XLogP2.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 54917499
1-(4-aminobutylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682163
1-[(4-ethylphenyl)methylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682734
1-[2-[cyclopropyl(methyl)amino]ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 107682345
1-[2-(trifluoromethylsulfanyl)ethylamino]-2,3-dihydro-1H-inden-5-ol
CID 114187434
1-(2-methylsulfinylethylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682669
2-[(5-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]ethyl carbamate
CID 107682607
8-bromo-N-[2-(oxolan-2-yl)ethyl]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 61039503
1-[(2-ethyl-2-hydroxybutyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107682417
5-[(4-hydroxyphenyl)methylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 114331480
1-(2-bromoprop-2-enylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682656
4-methyl-N-[2-(oxolan-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81297954

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol (CID 107682224) is 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol is Oc1ccc2c(c1)CCC2NCCC1CCCO1.
What is the InChIKey of 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is JRQVPYJTFPKBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c17-12-4-5-14-11(10-12)3-6-15(14)16-8-7-13-2-1-9-18-13/h4-5,10,13,15-17H,1-3,6-9H2.
What are the key properties of 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol?
1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 247.34 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107682224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).