2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole

C12H17NO — CID 117193542

IUPAC2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole
SMILESCOCC1(C)Cc2cc(C)ccc2N1
InChIInChI=1S/C12H17NO/c1-9-4-5-11-10(6-9)7-12(2,13-11)8-14-3/h4-6,13H,7-8H2,1-3H3
InChIKeyGFQFASMNQONBIV-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.37
Rot. Bonds2

About 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole

2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole (PubChem CID 117193542) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole.

Molecular Properties

Compound Name2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole
PubChem CID117193542
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole
SMILESCOCC1(C)Cc2cc(C)ccc2N1
InChIInChI=1S/C12H17NO/c1-9-4-5-11-10(6-9)7-12(2,13-11)8-14-3/h4-6,13H,7-8H2,1-3H3
InChIKeyGFQFASMNQONBIV-UHFFFAOYSA-N
XLogP2.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole?
The IUPAC name of 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole (CID 117193542) is 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole.
What is the SMILES notation for 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole?
The canonical SMILES for 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole is COCC1(C)Cc2cc(C)ccc2N1.
What is the InChIKey of 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole?
The InChIKey is GFQFASMNQONBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9-4-5-11-10(6-9)7-12(2,13-11)8-14-3/h4-6,13H,7-8H2,1-3H3.
What are the key properties of 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole?
2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole has a molecular weight of 191.27 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2,5-dimethyl-1,3-dihydroindole is sourced from PubChem (CID 117193542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).