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

C9H11NO — CID 6931156

IUPAC(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol
SMILESN[C@H]1c2ccccc2C[C@@H]1O
InChIInChI=1S/C9H11NO/c10-9-7-4-2-1-3-6(7)5-8(9)11/h1-4,8-9,11H,5,10H2/t8-,9-/m0/s1
InChIKeyLOPKSXMQWBYUOI-IUCAKERBSA-N
MW149.19 g/mol
LogP0.60
Rot. Bonds

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

(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol (PubChem CID 6931156) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol.

Molecular Properties

Compound Name(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol
PubChem CID6931156
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol
SMILESN[C@H]1c2ccccc2C[C@@H]1O
InChIInChI=1S/C9H11NO/c10-9-7-4-2-1-3-6(7)5-8(9)11/h1-4,8-9,11H,5,10H2/t8-,9-/m0/s1
InChIKeyLOPKSXMQWBYUOI-IUCAKERBSA-N
XLogP0.60
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-Amino-2-phenylethanol
CID 92466
(R)-beta-aminophenethyl alcohol
CID 2724025
(1R,2S)-(+)-cis-1-Amino-2-indanol
CID 2725045
(1S,2R)-(-)-1-Amino-2-indanol
CID 9866743
2-amino-2,3-dihydro-1H-inden-1-ol hydrochloride
CID 203118
2-Amino-2-phenylethan-1-ol
CID 134797
1-Amino-2-indanol
CID 139034
1,3a,4,8b-Tetrahydroindeno[1,2-d]oxathiazole 2,2-dioxide
CID 10013378
((1R,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl)thiourea
CID 3072136
1-Amino-2-indanol, trans-(-)-
CID 6931154
3-amino-2,3-dihydro-1H-inden-1-ol
CID 9855521
(1R,2R)-2-Amino-2,3-dihydro-1H-inden-1-ol
CID 10898857

Frequently Asked Questions

What is the IUPAC name of (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol?
The IUPAC name of (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol (CID 6931156) is (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol.
What is the SMILES notation for (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol?
The canonical SMILES for (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol is N[C@H]1c2ccccc2C[C@@H]1O.
What is the InChIKey of (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol?
The InChIKey is LOPKSXMQWBYUOI-IUCAKERBSA-N. The full InChI is InChI=1S/C9H11NO/c10-9-7-4-2-1-3-6(7)5-8(9)11/h1-4,8-9,11H,5,10H2/t8-,9-/m0/s1.
What are the key properties of (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol?
(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol has a molecular weight of 149.19 g/mol, XLogP of 0.60, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S)-1-amino-2,3-dihydro-1H-inden-2-ol is sourced from PubChem (CID 6931156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).