spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]

C20H15NO — CID 67909046

IUPACspiro[1,3-dihydroindole-2,1'-benzo[f]chromene]
SMILESC1=CC2(Cc3ccccc3N2)c2c(ccc3ccccc23)O1
InChIInChI=1S/C20H15NO/c1-3-7-16-14(5-1)9-10-18-19(16)20(11-12-22-18)13-15-6-2-4-8-17(15)21-20/h1-12,21H,13H2
InChIKeyMLZIRKHEEZBRHP-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.61
Rot. Bonds

About spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]

spiro[1,3-dihydroindole-2,1'-benzo[f]chromene] (PubChem CID 67909046) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is spiro[1,3-dihydroindole-2,1'-benzo[f]chromene].

Molecular Properties

Compound Namespiro[1,3-dihydroindole-2,1'-benzo[f]chromene]
PubChem CID67909046
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Namespiro[1,3-dihydroindole-2,1'-benzo[f]chromene]
SMILESC1=CC2(Cc3ccccc3N2)c2c(ccc3ccccc23)O1
InChIInChI=1S/C20H15NO/c1-3-7-16-14(5-1)9-10-18-19(16)20(11-12-22-18)13-15-6-2-4-8-17(15)21-20/h1-12,21H,13H2
InChIKeyMLZIRKHEEZBRHP-UHFFFAOYSA-N
XLogP4.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]?
The IUPAC name of spiro[1,3-dihydroindole-2,1'-benzo[f]chromene] (CID 67909046) is spiro[1,3-dihydroindole-2,1'-benzo[f]chromene].
What is the SMILES notation for spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]?
The canonical SMILES for spiro[1,3-dihydroindole-2,1'-benzo[f]chromene] is C1=CC2(Cc3ccccc3N2)c2c(ccc3ccccc23)O1.
What is the InChIKey of spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]?
The InChIKey is MLZIRKHEEZBRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c1-3-7-16-14(5-1)9-10-18-19(16)20(11-12-22-18)13-15-6-2-4-8-17(15)21-20/h1-12,21H,13H2.
What are the key properties of spiro[1,3-dihydroindole-2,1'-benzo[f]chromene]?
spiro[1,3-dihydroindole-2,1'-benzo[f]chromene] has a molecular weight of 285.35 g/mol, XLogP of 4.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,3-dihydroindole-2,1'-benzo[f]chromene] is sourced from PubChem (CID 67909046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).