1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one

C15H12N2O3 — CID 172746024

IUPAC1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one
SMILESO=C1N(c2ccccn2)c2ccccc2C12OCCO2
InChIInChI=1S/C15H12N2O3/c18-14-15(19-9-10-20-15)11-5-1-2-6-12(11)17(14)13-7-3-4-8-16-13/h1-8H,9-10H2
InChIKeyJSRIHKBEIOMDGL-UHFFFAOYSA-N
MW268.27 g/mol
LogP1.96
Rot. Bonds1

About 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one

1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one (PubChem CID 172746024) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one.

Molecular Properties

Compound Name1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one
PubChem CID172746024
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one
SMILESO=C1N(c2ccccn2)c2ccccc2C12OCCO2
InChIInChI=1S/C15H12N2O3/c18-14-15(19-9-10-20-15)11-5-1-2-6-12(11)17(14)13-7-3-4-8-16-13/h1-8H,9-10H2
InChIKeyJSRIHKBEIOMDGL-UHFFFAOYSA-N
XLogP1.96
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1'-(2-morpholin-4-ylsulfonylphenyl)spiro[1,3-dioxolane-2,3'-indole]-2'-one
CID 68654087
1'-benzylspiro[1,3-dioxolane-2,3'-indole]-2'-one
CID 7036178
1'-prop-2-enylspiro[1,3-dioxolane-2,3'-indole]-2'-one
CID 7036177
2-(2'-oxospiro[1,3-dioxolane-2,3'-indole]-1'-yl)acetate
CID 1247232
9,9-dimethyl-10-pyridin-2-ylacridin-3-ol
CID 118539200
1'-dodecylspiro[1,3-dioxolane-2,3'-indole]-2'-one
CID 18889643
11-pyridin-2-yl-5,6-dihydrobenzo[b][1]benzazepine
CID 132545002
3-pyridin-2-yl-1,3-oxazolidine-2,4-dione
CID 130058085
2-pyridin-2-yl-2-azaspiro[4.4]nonane-1,3-dione
CID 11957948
1'-(benzenesulfonyl)spiro[1,3-dioxane-2,3'-indole]-2'-one
CID 67532384
1-morpholin-4-yl-3,3-bis(pyridin-2-ylmethyl)indol-2-one
CID 15284402
6-pyridin-2-yl-6-azatetracyclo[6.5.2.04,15.011,14]pentadeca-1(14),2,4(15),8,10-pentaene-5,7-dione
CID 22696549

Frequently Asked Questions

What is the IUPAC name of 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one?
The IUPAC name of 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one (CID 172746024) is 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one.
What is the SMILES notation for 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one?
The canonical SMILES for 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one is O=C1N(c2ccccn2)c2ccccc2C12OCCO2.
What is the InChIKey of 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one?
The InChIKey is JSRIHKBEIOMDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c18-14-15(19-9-10-20-15)11-5-1-2-6-12(11)17(14)13-7-3-4-8-16-13/h1-8H,9-10H2.
What are the key properties of 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one?
1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one has a molecular weight of 268.27 g/mol, XLogP of 1.96, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-pyridin-2-ylspiro[1,3-dioxolane-2,3'-indole]-2'-one is sourced from PubChem (CID 172746024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).