5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one

C10H8FNO3 — CID 2856422

IUPAC5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(F)cc2C12OCCO2
InChIInChI=1S/C10H8FNO3/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13)
InChIKeyDMBPYQDOLDEAIM-UHFFFAOYSA-N
MW209.18 g/mol
LogP0.98
Rot. Bonds

About 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one

5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one (PubChem CID 2856422) has the molecular formula C10H8FNO3 and a molecular weight of 209.18 g/mol. Its IUPAC name is 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one.

Molecular Properties

Compound Name5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
PubChem CID2856422
Molecular FormulaC10H8FNO3
Molecular Weight209.18 g/mol
Exact Mass209.05
IUPAC Name5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(F)cc2C12OCCO2
InChIInChI=1S/C10H8FNO3/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13)
InChIKeyDMBPYQDOLDEAIM-UHFFFAOYSA-N
XLogP0.98
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.18
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trispiro[indole-3,2'-[1,3]dioxane-5',5''-[1,3]dioxane-2'',3'''-indole]-2,2'''(1H,1'''H)-dione
CID 644733
3-(2'-Oxospiro[[1,3]dioxolane-2,3'-indolin]-1'-yl)propanenitrile
CID 600599
1'-Allyl-5'-methylspiro[[1,3]dioxolane-2,3'-indolin]-2'-one
CID 690354
4-methylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
CID 2921040
Spiro(1,3-dioxolane-2,3'-(3H)indol)-2'(1'H)-one
CID 281156
5,5-dimethylspiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
CID 609514
6-Prop-2-ynylspiro[1,3-dioxolane-2,3'-indoline]-7-one
CID 699047
5-methyl-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
CID 2972737
5',7'-dimethylspiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
CID 7013279
5-(Hydroxymethyl)-5-methylspiro[1,3-dioxane-2,3'-indoline]-8-one
CID 17380042
5-Ethyl-5-methylspiro[1,3-dioxane-2,3'-indoline]-8-one
CID 577292
1'-(2-oxopentyl)spiro[1,3-dioxolane-2,3'-indol]-2'(1'H)-one
CID 3245741

Frequently Asked Questions

What is the IUPAC name of 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The IUPAC name of 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one (CID 2856422) is 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one.
What is the SMILES notation for 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The canonical SMILES for 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one is O=C1Nc2ccc(F)cc2C12OCCO2.
What is the InChIKey of 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
The InChIKey is DMBPYQDOLDEAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO3/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13).
What are the key properties of 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one?
5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one has a molecular weight of 209.18 g/mol, XLogP of 0.98, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-fluorospiro[1,3-dioxolane-2,3'-1H-indole]-2'-one is sourced from PubChem (CID 2856422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).