spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one

C16H13NO2 — CID 166063555

IUPACspiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one
SMILESO=C1Nc2ccccc2C12CCc1ccccc1O2
InChIInChI=1S/C16H13NO2/c18-15-16(12-6-2-3-7-13(12)17-15)10-9-11-5-1-4-8-14(11)19-16/h1-8H,9-10H2,(H,17,18)
InChIKeyGEANSAHNOWOCKI-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.86
Rot. Bonds

About spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one

spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one (PubChem CID 166063555) has the molecular formula C16H13NO2 and a molecular weight of 251.29 g/mol. Its IUPAC name is spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one.

Molecular Properties

Compound Namespiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one
PubChem CID166063555
Molecular FormulaC16H13NO2
Molecular Weight251.29 g/mol
Exact Mass251.09
IUPAC Namespiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one
SMILESO=C1Nc2ccccc2C12CCc1ccccc1O2
InChIInChI=1S/C16H13NO2/c18-15-16(12-6-2-3-7-13(12)17-15)10-9-11-5-1-4-8-14(11)19-16/h1-8H,9-10H2,(H,17,18)
InChIKeyGEANSAHNOWOCKI-UHFFFAOYSA-N
XLogP2.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

spiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-2',4'-dione
CID 13053011
2'-iminospiro[1,2-dihydroindene-3,5'-1,3-oxazolidine]-4'-one
CID 140764521
spiro[1H-indole-3,8'-3,7-dihydro-2H-furo[3,2-h][1,4]benzodioxine]-2-one
CID 90146106
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988
2-(2-phenyl-3,4-dihydrochromen-2-yl)-1H-pyrrole
CID 175969922
(3S)-4'-(4-chlorophenyl)spiro[1H-indole-3,2'-3H-pyran]-2,6'-dione
CID 122221121
(2S,6S)-2,3-dimethylspiro[1,3-oxazinane-6,3'-1H-indole]-2'-one
CID 162959161
2,2-difluoro-3,4-dihydrochromene
CID 14418574
2-(2-methyl-3,4-dihydrochromen-2-yl)phenol
CID 134834710
(1'R,3R)-1'-methylspiro[1H-indole-3,3'-4,5,6,7-tetrahydro-1H-cyclopenta[c]pyran]-2-one
CID 139218215
4-methylspiro[1H-indole-3,5'-oxolane]-2,2'-dione
CID 132577226
CID 146949857
CID 146949857

Frequently Asked Questions

What is the IUPAC name of spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one?
The IUPAC name of spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one (CID 166063555) is spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one.
What is the SMILES notation for spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one?
The canonical SMILES for spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one is O=C1Nc2ccccc2C12CCc1ccccc1O2.
What is the InChIKey of spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one?
The InChIKey is GEANSAHNOWOCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c18-15-16(12-6-2-3-7-13(12)17-15)10-9-11-5-1-4-8-14(11)19-16/h1-8H,9-10H2,(H,17,18).
What are the key properties of spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one?
spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one has a molecular weight of 251.29 g/mol, XLogP of 2.86, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1H-indole-3,2'-3,4-dihydrochromene]-2-one is sourced from PubChem (CID 166063555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).