7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one

C11H10FNO — CID 106702100

IUPAC7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESCC1CC12C(=O)Nc1c(F)cccc12
InChIInChI=1S/C11H10FNO/c1-6-5-11(6)7-3-2-4-8(12)9(7)13-10(11)14/h2-4,6H,5H2,1H3,(H,13,14)
InChIKeySOGVBWSMZCIIAJ-UHFFFAOYSA-N
MW191.20 g/mol
LogP2.06
Rot. Bonds

About 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one

7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one (PubChem CID 106702100) has the molecular formula C11H10FNO and a molecular weight of 191.20 g/mol. Its IUPAC name is 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one.

Molecular Properties

Compound Name7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
PubChem CID106702100
Molecular FormulaC11H10FNO
Molecular Weight191.20 g/mol
Exact Mass191.07
IUPAC Name7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESCC1CC12C(=O)Nc1c(F)cccc12
InChIInChI=1S/C11H10FNO/c1-6-5-11(6)7-3-2-4-8(12)9(7)13-10(11)14/h2-4,6H,5H2,1H3,(H,13,14)
InChIKeySOGVBWSMZCIIAJ-UHFFFAOYSA-N
XLogP2.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.20
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The IUPAC name of 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one (CID 106702100) is 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one.
What is the SMILES notation for 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The canonical SMILES for 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one is CC1CC12C(=O)Nc1c(F)cccc12.
What is the InChIKey of 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The InChIKey is SOGVBWSMZCIIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO/c1-6-5-11(6)7-3-2-4-8(12)9(7)13-10(11)14/h2-4,6H,5H2,1H3,(H,13,14).
What are the key properties of 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one has a molecular weight of 191.20 g/mol, XLogP of 2.06, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2'-methylspiro[1H-indole-3,1'-cyclopropane]-2-one is sourced from PubChem (CID 106702100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).