3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol

C19H19NO — CID 57318643

IUPAC3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol
SMILESOC1Nc2ccccc2C1=Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C19H19NO/c21-19-17(16-7-3-4-8-18(16)20-19)12-13-9-10-14-5-1-2-6-15(14)11-13/h3-4,7-12,19-21H,1-2,5-6H2
InChIKeyBOFBDMFMQVPVSW-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.85
Rot. Bonds1

About 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol

3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol (PubChem CID 57318643) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol.

Molecular Properties

Compound Name3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol
PubChem CID57318643
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol
SMILESOC1Nc2ccccc2C1=Cc1ccc2c(c1)CCCC2
InChIInChI=1S/C19H19NO/c21-19-17(16-7-3-4-8-18(16)20-19)12-13-9-10-14-5-1-2-6-15(14)11-13/h3-4,7-12,19-21H,1-2,5-6H2
InChIKeyBOFBDMFMQVPVSW-UHFFFAOYSA-N
XLogP3.85
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol?
The IUPAC name of 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol (CID 57318643) is 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol.
What is the SMILES notation for 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol?
The canonical SMILES for 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol is OC1Nc2ccccc2C1=Cc1ccc2c(c1)CCCC2.
What is the InChIKey of 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol?
The InChIKey is BOFBDMFMQVPVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c21-19-17(16-7-3-4-8-18(16)20-19)12-13-9-10-14-5-1-2-6-15(14)11-13/h3-4,7-12,19-21H,1-2,5-6H2.
What are the key properties of 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol?
3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol has a molecular weight of 277.37 g/mol, XLogP of 3.85, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,6,7,8-tetrahydronaphthalen-2-ylmethylidene)-1,2-dihydroindol-2-ol is sourced from PubChem (CID 57318643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).