2-(1-methylindol-5-yl)isoindol-1-ol

C17H14N2O — CID 91339272

IUPAC2-(1-methylindol-5-yl)isoindol-1-ol
SMILESCn1ccc2cc(-n3cc4ccccc4c3O)ccc21
InChIInChI=1S/C17H14N2O/c1-18-9-8-12-10-14(6-7-16(12)18)19-11-13-4-2-3-5-15(13)17(19)20/h2-11,20H,1H3
InChIKeySCOJYMKDQXRSLV-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.83
Rot. Bonds1

About 2-(1-methylindol-5-yl)isoindol-1-ol

2-(1-methylindol-5-yl)isoindol-1-ol (PubChem CID 91339272) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-(1-methylindol-5-yl)isoindol-1-ol.

Molecular Properties

Compound Name2-(1-methylindol-5-yl)isoindol-1-ol
PubChem CID91339272
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name2-(1-methylindol-5-yl)isoindol-1-ol
SMILESCn1ccc2cc(-n3cc4ccccc4c3O)ccc21
InChIInChI=1S/C17H14N2O/c1-18-9-8-12-10-14(6-7-16(12)18)19-11-13-4-2-3-5-15(13)17(19)20/h2-11,20H,1H3
InChIKeySCOJYMKDQXRSLV-UHFFFAOYSA-N
XLogP3.83
TPSA30.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,6-dimethoxy-2-(1-methylindol-5-yl)isoindol-1-ol
CID 90702021
2-(1-methylindol-5-yl)-6-nitroisoindol-1-ol
CID 91609054
5-chloro-2-(1-methylindol-6-yl)isoindol-1-ol
CID 91519522
N-[3-hydroxy-2-(1-methylindol-6-yl)isoindol-5-yl]benzamide
CID 91411221
2-(4-propan-2-ylphenyl)isoindol-1-ol
CID 90763500
2-(1-propan-2-ylindol-5-yl)-6-propylisoindol-1-ol
CID 90693809
ethane;1-methylindole
CID 91600075
2-(1,2-dimethylindol-5-yl)-6-ethylisoindol-1-ol
CID 91249384
bis(1-methylindol-5-yl)borinic acid
CID 140671665
5-(1-methylindol-5-yl)-1-phenylpyridin-2-one
CID 58016427
1-methylindole;bis(triethyl-(1-methylindol-2-yl)silane)
CID 159581011
2-(1-methylindol-5-yl)-3H-isoindol-1-one
CID 59543218

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-5-yl)isoindol-1-ol?
The IUPAC name of 2-(1-methylindol-5-yl)isoindol-1-ol (CID 91339272) is 2-(1-methylindol-5-yl)isoindol-1-ol.
What is the SMILES notation for 2-(1-methylindol-5-yl)isoindol-1-ol?
The canonical SMILES for 2-(1-methylindol-5-yl)isoindol-1-ol is Cn1ccc2cc(-n3cc4ccccc4c3O)ccc21.
What is the InChIKey of 2-(1-methylindol-5-yl)isoindol-1-ol?
The InChIKey is SCOJYMKDQXRSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-18-9-8-12-10-14(6-7-16(12)18)19-11-13-4-2-3-5-15(13)17(19)20/h2-11,20H,1H3.
What are the key properties of 2-(1-methylindol-5-yl)isoindol-1-ol?
2-(1-methylindol-5-yl)isoindol-1-ol has a molecular weight of 262.31 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-5-yl)isoindol-1-ol is sourced from PubChem (CID 91339272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).