2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one

C11H12N2O — CID 84719127

IUPAC2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESCc1ccc2c(c1)NC(=O)C21CC1N
InChIInChI=1S/C11H12N2O/c1-6-2-3-7-8(4-6)13-10(14)11(7)5-9(11)12/h2-4,9H,5,12H2,1H3,(H,13,14)
InChIKeySYESOEXRUQNJGN-UHFFFAOYSA-N
MW188.23 g/mol
LogP0.92
Rot. Bonds

About 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one

2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one (PubChem CID 84719127) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one.

Molecular Properties

Compound Name2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
PubChem CID84719127
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESCc1ccc2c(c1)NC(=O)C21CC1N
InChIInChI=1S/C11H12N2O/c1-6-2-3-7-8(4-6)13-10(14)11(7)5-9(11)12/h2-4,9H,5,12H2,1H3,(H,13,14)
InChIKeySYESOEXRUQNJGN-UHFFFAOYSA-N
XLogP0.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2'-amino-6-methoxyspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 84721821
2'-amino-5-hydroxyspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 84719468
(2'R,3R)-2'-(hydroxymethyl)-5-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 52915747
4',4'-difluoro-6-methylspiro[1H-indole-3,1'-cyclohexane]-2-one
CID 70960495
(2'S,3R)-2'-(4-methylphenyl)-2-oxospiro[1H-indole-3,1'-cyclopropane]-5-carboxylic acid
CID 99979195
(5R)-5-amino-6',13'-dimethylspiro[pyrrolidine-3,2'-tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene]-2-one
CID 70646915
3,6,9,9-tetramethyl-10H-acridine
CID 155683472
3-amino-6-methyl-1,3-dihydroindol-2-one
CID 71306235
5-methylspiro[1H-indole-3,4'-cyclohexane]-1',2-dione
CID 156760180
3-tert-butylperoxy-3-(tert-butylperoxymethyl)-6-methyl-1H-indol-2-one
CID 102050554
4',4'-difluoro-5-methylspiro[1H-indole-3,1'-cyclohexane]-2-one
CID 106702132
(2'S,3R)-2'-(3-iodo-2H-indazol-6-yl)-5-methylspiro[1H-indole-3,1'-cyclopropane]-2-one
CID 58486369

Frequently Asked Questions

What is the IUPAC name of 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The IUPAC name of 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one (CID 84719127) is 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one.
What is the SMILES notation for 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The canonical SMILES for 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one is Cc1ccc2c(c1)NC(=O)C21CC1N.
What is the InChIKey of 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The InChIKey is SYESOEXRUQNJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-6-2-3-7-8(4-6)13-10(14)11(7)5-9(11)12/h2-4,9H,5,12H2,1H3,(H,13,14).
What are the key properties of 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one?
2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one has a molecular weight of 188.23 g/mol, XLogP of 0.92, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-amino-6-methylspiro[1H-indole-3,1'-cyclopropane]-2-one is sourced from PubChem (CID 84719127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).