2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium

C9H13NO2Y — CID 166486218

IUPAC2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium
SMILESCO.Oc1ccc2c(c1)CNC2.[Y]
InChIInChI=1S/C8H9NO.CH4O.Y/c10-8-2-1-6-4-9-5-7(6)3-8;1-2;/h1-3,9-10H,4-5H2;2H,1H3;
InChIKeySBFUUQSQFBCVQC-UHFFFAOYSA-N
MW256.11 g/mol
LogP0.60
Rot. Bonds

About 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium

2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium (PubChem CID 166486218) has the molecular formula C9H13NO2Y and a molecular weight of 256.11 g/mol. Its IUPAC name is 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium.

Molecular Properties

Compound Name2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium
PubChem CID166486218
Molecular FormulaC9H13NO2Y
Molecular Weight256.11 g/mol
Exact Mass256.00
IUPAC Name2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium
SMILESCO.Oc1ccc2c(c1)CNC2.[Y]
InChIInChI=1S/C8H9NO.CH4O.Y/c10-8-2-1-6-4-9-5-7(6)3-8;1-2;/h1-3,9-10H,4-5H2;2H,1H3;
InChIKeySBFUUQSQFBCVQC-UHFFFAOYSA-N
XLogP0.60
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.11
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium?
The IUPAC name of 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium (CID 166486218) is 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium.
What is the SMILES notation for 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium?
The canonical SMILES for 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium is CO.Oc1ccc2c(c1)CNC2.[Y].
What is the InChIKey of 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium?
The InChIKey is SBFUUQSQFBCVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO.CH4O.Y/c10-8-2-1-6-4-9-5-7(6)3-8;1-2;/h1-3,9-10H,4-5H2;2H,1H3;.
What are the key properties of 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium?
2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium has a molecular weight of 256.11 g/mol, XLogP of 0.60, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-isoindol-5-ol;methanol;yttrium is sourced from PubChem (CID 166486218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).