(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol

C11H14O — CID 130811012

IUPAC(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol
SMILESCC[C@H]1c2ccccc2C[C@@H]1O
InChIInChI=1S/C11H14O/c1-2-9-10-6-4-3-5-8(10)7-11(9)12/h3-6,9,11-12H,2,7H2,1H3/t9-,11-/m0/s1
InChIKeyFIDDCSAAULITCX-ONGXEEELSA-N
MW162.23 g/mol
LogP2.10
Rot. Bonds1

About (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol

(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol (PubChem CID 130811012) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol.

Molecular Properties

Compound Name(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol
PubChem CID130811012
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol
SMILESCC[C@H]1c2ccccc2C[C@@H]1O
InChIInChI=1S/C11H14O/c1-2-9-10-6-4-3-5-8(10)7-11(9)12/h3-6,9,11-12H,2,7H2,1H3/t9-,11-/m0/s1
InChIKeyFIDDCSAAULITCX-ONGXEEELSA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-methyl-2,3-dihydro-1H-inden-2-ol
CID 89059414
1-ethoxy-2,3-dihydro-1H-inden-2-ol
CID 12602279
(1S)-2,3-dihydro-1H-indene-1,2-diol
CID 68820122
3-ethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 89150261
(1S,2S)-1-ethyl-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 163236306
ethane;[(1S)-2-methyl-2,3-dihydro-1H-inden-1-yl]methanol
CID 142999040
(1R,2S)-1-(2-ethylsulfanylethylamino)-2,3-dihydro-1H-inden-2-ol
CID 75457077
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]propanamide
CID 15432723
CID 87918176
CID 87918176
(1R)-1-propyl-2,3-dihydro-1H-inden-2-amine
CID 143271430
(1S,2R)-2-(diethylamino)-2,3-dihydro-1H-inden-1-ol
CID 131856725
(1R,2S)-1-(2-methylpropylamino)-2,3-dihydro-1H-inden-2-ol
CID 103880518

Frequently Asked Questions

What is the IUPAC name of (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol?
The IUPAC name of (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol (CID 130811012) is (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol.
What is the SMILES notation for (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol?
The canonical SMILES for (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol is CC[C@H]1c2ccccc2C[C@@H]1O.
What is the InChIKey of (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol?
The InChIKey is FIDDCSAAULITCX-ONGXEEELSA-N. The full InChI is InChI=1S/C11H14O/c1-2-9-10-6-4-3-5-8(10)7-11(9)12/h3-6,9,11-12H,2,7H2,1H3/t9-,11-/m0/s1.
What are the key properties of (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol?
(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol has a molecular weight of 162.23 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol is sourced from PubChem (CID 130811012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).