3-phenyl-2,3-dihydro-1H-isoindol-5-ol

C14H13NO — CID 84734566

IUPAC3-phenyl-2,3-dihydro-1H-isoindol-5-ol
SMILESOc1ccc2c(c1)C(c1ccccc1)NC2
InChIInChI=1S/C14H13NO/c16-12-7-6-11-9-15-14(13(11)8-12)10-4-2-1-3-5-10/h1-8,14-16H,9H2
InChIKeyKHMFMRDJQGDLHI-UHFFFAOYSA-N
MW211.26 g/mol
LogP2.58
Rot. Bonds1

About 3-phenyl-2,3-dihydro-1H-isoindol-5-ol

3-phenyl-2,3-dihydro-1H-isoindol-5-ol (PubChem CID 84734566) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is 3-phenyl-2,3-dihydro-1H-isoindol-5-ol.

Molecular Properties

Compound Name3-phenyl-2,3-dihydro-1H-isoindol-5-ol
PubChem CID84734566
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name3-phenyl-2,3-dihydro-1H-isoindol-5-ol
SMILESOc1ccc2c(c1)C(c1ccccc1)NC2
InChIInChI=1S/C14H13NO/c16-12-7-6-11-9-15-14(13(11)8-12)10-4-2-1-3-5-10/h1-8,14-16H,9H2
InChIKeyKHMFMRDJQGDLHI-UHFFFAOYSA-N
XLogP2.58
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 83970735
6-hydroxy-2,3-dihydro-1H-isoindole-1-carboxylic acid
CID 130040307
4-(6-methoxy-2,3-dihydro-1H-isoindol-1-yl)phenol
CID 84737041
3-(2-methylpropyl)-2,3-dihydro-1H-isoindol-5-ol
CID 84733032
1-phenyl-2,3-dihydro-1H-isoindol-4-ol
CID 84734564
(5R)-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-7-ol
CID 10037257
1-(3-cyclobutylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 106543809
3-cycloheptyl-2,3-dihydro-1H-isoindol-5-ol
CID 84736259
1-(4-tert-butylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 106543718
1-(3-cyclobutylphenyl)-2,3-dihydro-1H-isoindole
CID 114605983
1-(4-hydroxyphenyl)-2,3-dihydro-1H-isoindol-4-ol
CID 84735897
1-(4-propan-2-yloxyphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol
CID 106543727

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2,3-dihydro-1H-isoindol-5-ol?
The IUPAC name of 3-phenyl-2,3-dihydro-1H-isoindol-5-ol (CID 84734566) is 3-phenyl-2,3-dihydro-1H-isoindol-5-ol.
What is the SMILES notation for 3-phenyl-2,3-dihydro-1H-isoindol-5-ol?
The canonical SMILES for 3-phenyl-2,3-dihydro-1H-isoindol-5-ol is Oc1ccc2c(c1)C(c1ccccc1)NC2.
What is the InChIKey of 3-phenyl-2,3-dihydro-1H-isoindol-5-ol?
The InChIKey is KHMFMRDJQGDLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c16-12-7-6-11-9-15-14(13(11)8-12)10-4-2-1-3-5-10/h1-8,14-16H,9H2.
What are the key properties of 3-phenyl-2,3-dihydro-1H-isoindol-5-ol?
3-phenyl-2,3-dihydro-1H-isoindol-5-ol has a molecular weight of 211.26 g/mol, XLogP of 2.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2,3-dihydro-1H-isoindol-5-ol is sourced from PubChem (CID 84734566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).