3-(methoxymethyl)-1-methylindole

C11H13NO — CID 18711466

IUPAC3-(methoxymethyl)-1-methylindole
SMILESCOCc1cn(C)c2ccccc12
InChIInChI=1S/C11H13NO/c1-12-7-9(8-13-2)10-5-3-4-6-11(10)12/h3-7H,8H2,1-2H3
InChIKeyMTUSUSJSJMGHPA-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.32
Rot. Bonds2

About 3-(methoxymethyl)-1-methylindole

3-(methoxymethyl)-1-methylindole (PubChem CID 18711466) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-methylindole.

Molecular Properties

Compound Name3-(methoxymethyl)-1-methylindole
PubChem CID18711466
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name3-(methoxymethyl)-1-methylindole
SMILESCOCc1cn(C)c2ccccc12
InChIInChI=1S/C11H13NO/c1-12-7-9(8-13-2)10-5-3-4-6-11(10)12/h3-7H,8H2,1-2H3
InChIKeyMTUSUSJSJMGHPA-UHFFFAOYSA-N
XLogP2.32
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-chlorophenoxy)methyl]-1-methylindole
CID 117171277
3-(methoxymethyl)-N-[(1-methylindol-3-yl)methyl]aniline
CID 107234938
N-(methoxymethyl)-N-methyl-2-(1-methylindol-3-yl)ethanamine
CID 115259030
3-(2-bromoethyl)-1-methylindole
CID 13153306
N-(2-methoxyethyl)-2-(1-methylindol-3-yl)acetamide
CID 3237946
N-ethoxy-1-(1-methylindol-3-yl)methanamine
CID 107236064
3-(1-methylindol-3-yl)propan-1-amine
CID 3930315
3-[(2-ethylphenyl)methyl]-1-methylindole
CID 162400454
3-methoxy-2-[(1-methylindol-3-yl)methylamino]propan-1-ol
CID 106187372
methyl N-[2-(1-methylindol-3-yl)ethyl]carbamate
CID 14613226
methanamine;2-(1-methylindol-3-yl)acetaldehyde
CID 145482195
3-decyl-1-methylindole
CID 10802084

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-methylindole?
The IUPAC name of 3-(methoxymethyl)-1-methylindole (CID 18711466) is 3-(methoxymethyl)-1-methylindole.
What is the SMILES notation for 3-(methoxymethyl)-1-methylindole?
The canonical SMILES for 3-(methoxymethyl)-1-methylindole is COCc1cn(C)c2ccccc12.
What is the InChIKey of 3-(methoxymethyl)-1-methylindole?
The InChIKey is MTUSUSJSJMGHPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-12-7-9(8-13-2)10-5-3-4-6-11(10)12/h3-7H,8H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-1-methylindole?
3-(methoxymethyl)-1-methylindole has a molecular weight of 175.23 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-methylindole is sourced from PubChem (CID 18711466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).