1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane

C14H19NO — CID 176997372

IUPAC1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane
SMILESCC.Cc1ccc2c(c1)N(C)C(=O)C21CC1
InChIInChI=1S/C12H13NO.C2H6/c1-8-3-4-9-10(7-8)13(2)11(14)12(9)5-6-12;1-2/h3-4,7H,5-6H2,1-2H3;1-2H3
InChIKeyRWBGCPVTEIGRHR-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.03
Rot. Bonds

About 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane

1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane (PubChem CID 176997372) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane.

Molecular Properties

Compound Name1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane
PubChem CID176997372
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane
SMILESCC.Cc1ccc2c(c1)N(C)C(=O)C21CC1
InChIInChI=1S/C12H13NO.C2H6/c1-8-3-4-9-10(7-8)13(2)11(14)12(9)5-6-12;1-2/h3-4,7H,5-6H2,1-2H3;1-2H3
InChIKeyRWBGCPVTEIGRHR-UHFFFAOYSA-N
XLogP3.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1',5'-dimethylspiro[cyclopentane-1,3'-indole]-2'-one;1',5'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;1,3,3,5-tetramethylindol-2-one
CID 161024534
1'-methylspiro[cyclopropane-1,3'-indole]-2'-one
CID 14317864
3,3-dimethoxy-1,6-dimethylindol-2-one
CID 54543930
(1-methyl-2-oxospiro[indole-3,4'-oxane]-6-yl)carbamic acid
CID 146524669
1,5-dimethylspiro[7H-pyrrolo[3,2-g]phthalazine-3,1'-cyclopropane]-2,8-dione
CID 167310769
tert-butyl 6-methyl-2-oxo-1-propan-2-ylspiro[indole-3,4'-piperidine]-1'-carboxylate
CID 59655954
CID 164582213
CID 164582213
CID 59909654
CID 59909654
(3R)-6-methyl-1-propan-2-ylspiro[indole-3,3'-piperidine]-2-one
CID 70113018
N-[[(1'-methyl-2'-oxospiro[cyclopropane-1,3'-indole]-6'-yl)amino]methyl]prop-2-enamide
CID 176996795
1',7'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one
CID 102104060
6-bromo-1-methyl-1'-(2,2,2-trifluoroacetyl)spiro[indole-3,4'-piperidine]-2-one
CID 162705629

Frequently Asked Questions

What is the IUPAC name of 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane?
The IUPAC name of 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane (CID 176997372) is 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane.
What is the SMILES notation for 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane?
The canonical SMILES for 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane is CC.Cc1ccc2c(c1)N(C)C(=O)C21CC1.
What is the InChIKey of 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane?
The InChIKey is RWBGCPVTEIGRHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO.C2H6/c1-8-3-4-9-10(7-8)13(2)11(14)12(9)5-6-12;1-2/h3-4,7H,5-6H2,1-2H3;1-2H3.
What are the key properties of 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane?
1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane has a molecular weight of 217.31 g/mol, XLogP of 3.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1',6'-dimethylspiro[cyclopropane-1,3'-indole]-2'-one;ethane is sourced from PubChem (CID 176997372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).