(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol

C11H15NO — CID 83001263

IUPAC(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
SMILESNC[C@@H](O)c1ccc2c(c1)CCC2
InChIInChI=1S/C11H15NO/c12-7-11(13)10-5-4-8-2-1-3-9(8)6-10/h4-6,11,13H,1-3,7,12H2/t11-/m1/s1
InChIKeyIDFAEJQKQCDPLU-LLVKDONJSA-N
MW177.25 g/mol
LogP1.17
Rot. Bonds2

About (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol

(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol (PubChem CID 83001263) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol.

Molecular Properties

Compound Name(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
PubChem CID83001263
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
SMILESNC[C@@H](O)c1ccc2c(c1)CCC2
InChIInChI=1S/C11H15NO/c12-7-11(13)10-5-4-8-2-1-3-9(8)6-10/h4-6,11,13H,1-3,7,12H2/t11-/m1/s1
InChIKeyIDFAEJQKQCDPLU-LLVKDONJSA-N
XLogP1.17
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-sulfanyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 116830936
1-(2,3-dihydro-1H-inden-5-yl)-4,4-dimethylpentan-1-ol
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2,3-dihydro-1H-inden-5-ylmethanediamine
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2-(2,3-dihydro-1H-inden-5-yl)-2-methoxyethanamine
CID 82111881
1-(2,3-dihydro-1H-inden-5-yl)-2-methylpropan-1-ol
CID 61087028
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Frequently Asked Questions

What is the IUPAC name of (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol?
The IUPAC name of (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol (CID 83001263) is (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol.
What is the SMILES notation for (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol?
The canonical SMILES for (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol is NC[C@@H](O)c1ccc2c(c1)CCC2.
What is the InChIKey of (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol?
The InChIKey is IDFAEJQKQCDPLU-LLVKDONJSA-N. The full InChI is InChI=1S/C11H15NO/c12-7-11(13)10-5-4-8-2-1-3-9(8)6-10/h4-6,11,13H,1-3,7,12H2/t11-/m1/s1.
What are the key properties of (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol?
(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol has a molecular weight of 177.25 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol is sourced from PubChem (CID 83001263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).