1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol

C15H21NO2 — CID 43637115

IUPAC1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol
SMILESCC(NC1CCc2c(O)cccc21)C1CCCO1
InChIInChI=1S/C15H21NO2/c1-10(15-6-3-9-18-15)16-13-8-7-12-11(13)4-2-5-14(12)17/h2,4-5,10,13,15-17H,3,6-9H2,1H3
InChIKeyZADRKVLVYQRCGX-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.54
Rot. Bonds3

About 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol

1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol (PubChem CID 43637115) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol.

Molecular Properties

Compound Name1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol
PubChem CID43637115
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol
SMILESCC(NC1CCc2c(O)cccc21)C1CCCO1
InChIInChI=1S/C15H21NO2/c1-10(15-6-3-9-18-15)16-13-8-7-12-11(13)4-2-5-14(12)17/h2,4-5,10,13,15-17H,3,6-9H2,1H3
InChIKeyZADRKVLVYQRCGX-UHFFFAOYSA-N
XLogP2.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
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-[1-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 43208516
1-(1-cyclobutylethylamino)-2,3-dihydro-1H-inden-4-ol
CID 115717656
1-[[(1S)-1-cyclohexylethyl]amino]-2,3-dihydro-1H-inden-4-ol
CID 81384182
4-methyl-N-[1-(oxolan-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81296486
1-(pentan-3-ylamino)-2,3-dihydro-1H-inden-4-ol
CID 43636908
1-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2,3-dihydro-1H-inden-4-ol
CID 43636969
1-[(1-hydroxy-3-methylbutan-2-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 79254434
1-(5-methylhexan-2-ylamino)-2,3-dihydro-1H-inden-4-ol
CID 43637043
1-[1-(5-methylfuran-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol
CID 43685026
1-[1-(2,6-difluorophenyl)ethylamino]-2,3-dihydro-1H-inden-4-ol
CID 60945188
1-[[(1S)-1-pyridin-4-ylethyl]amino]-2,3-dihydro-1H-inden-4-ol
CID 81406364
1-[(1-methoxy-3-methylbutan-2-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 65047922

Frequently Asked Questions

What is the IUPAC name of 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol?
The IUPAC name of 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol (CID 43637115) is 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol.
What is the SMILES notation for 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol?
The canonical SMILES for 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol is CC(NC1CCc2c(O)cccc21)C1CCCO1.
What is the InChIKey of 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol?
The InChIKey is ZADRKVLVYQRCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-10(15-6-3-9-18-15)16-13-8-7-12-11(13)4-2-5-14(12)17/h2,4-5,10,13,15-17H,3,6-9H2,1H3.
What are the key properties of 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol?
1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol has a molecular weight of 247.34 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(oxolan-2-yl)ethylamino]-2,3-dihydro-1H-inden-4-ol is sourced from PubChem (CID 43637115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).