spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]

C15H14N2O — CID 68534148

IUPACspiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]
SMILESc1ccc2c(c1)CC1(Cc3ccccc3ON1)N2
InChIInChI=1S/C15H14N2O/c1-3-7-13-11(5-1)9-15(16-13)10-12-6-2-4-8-14(12)18-17-15/h1-8,16-17H,9-10H2
InChIKeyRAIVLUVFNSASBS-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.49
Rot. Bonds

About spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]

spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine] (PubChem CID 68534148) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine].

Molecular Properties

Compound Namespiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]
PubChem CID68534148
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Namespiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]
SMILESc1ccc2c(c1)CC1(Cc3ccccc3ON1)N2
InChIInChI=1S/C15H14N2O/c1-3-7-13-11(5-1)9-15(16-13)10-12-6-2-4-8-14(12)18-17-15/h1-8,16-17H,9-10H2
InChIKeyRAIVLUVFNSASBS-UHFFFAOYSA-N
XLogP2.49
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]?
The IUPAC name of spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine] (CID 68534148) is spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine].
What is the SMILES notation for spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]?
The canonical SMILES for spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine] is c1ccc2c(c1)CC1(Cc3ccccc3ON1)N2.
What is the InChIKey of spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]?
The InChIKey is RAIVLUVFNSASBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-3-7-13-11(5-1)9-15(16-13)10-12-6-2-4-8-14(12)18-17-15/h1-8,16-17H,9-10H2.
What are the key properties of spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine]?
spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine] has a molecular weight of 238.29 g/mol, XLogP of 2.49, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,3-dihydroindole-2,3'-2,4-dihydro-1,2-benzoxazine] is sourced from PubChem (CID 68534148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).