1-(methoxymethyl)-5-methylindole

C11H13NO — CID 110831319

IUPAC1-(methoxymethyl)-5-methylindole
SMILESCOCn1ccc2cc(C)ccc21
InChIInChI=1S/C11H13NO/c1-9-3-4-11-10(7-9)5-6-12(11)8-13-2/h3-7H,8H2,1-2H3
InChIKeyQASCISVMVVORCB-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.55
Rot. Bonds2

About 1-(methoxymethyl)-5-methylindole

1-(methoxymethyl)-5-methylindole (PubChem CID 110831319) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-(methoxymethyl)-5-methylindole.

Molecular Properties

Compound Name1-(methoxymethyl)-5-methylindole
PubChem CID110831319
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name1-(methoxymethyl)-5-methylindole
SMILESCOCn1ccc2cc(C)ccc21
InChIInChI=1S/C11H13NO/c1-9-3-4-11-10(7-9)5-6-12(11)8-13-2/h3-7H,8H2,1-2H3
InChIKeyQASCISVMVVORCB-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methoxyethyl)-5-methylindole
CID 116622979
5-methyl-1-(phenylmethoxymethyl)indole
CID 102940732
1-methoxy-3-(5-methylindol-1-yl)propan-2-one
CID 107507773
1-(2,2-dimethylpropyl)-5-methylindole
CID 90966063
2-(5-methylindol-1-yl)acetaldehyde
CID 63554780
2-(5-methylindol-1-yl)ethanamine;hydrochloride
CID 91640635
1-(3-bicyclo[3.1.1]heptanylmethyl)-5-methylindole
CID 59004665
1-[(2-bromo-5-methoxyphenyl)methyl]-5-methylindole
CID 116622881
1-(methoxymethyl)indol-6-amine
CID 65365107
1-[(2-chloro-4-methylphenyl)methyl]-5-methylindole
CID 106870004
5-methyl-1-(oxiran-2-ylmethyl)indole
CID 54857157
5-methyl-1-(3-methylbut-3-enyl)indole
CID 114476776

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-5-methylindole?
The IUPAC name of 1-(methoxymethyl)-5-methylindole (CID 110831319) is 1-(methoxymethyl)-5-methylindole.
What is the SMILES notation for 1-(methoxymethyl)-5-methylindole?
The canonical SMILES for 1-(methoxymethyl)-5-methylindole is COCn1ccc2cc(C)ccc21.
What is the InChIKey of 1-(methoxymethyl)-5-methylindole?
The InChIKey is QASCISVMVVORCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-9-3-4-11-10(7-9)5-6-12(11)8-13-2/h3-7H,8H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-5-methylindole?
1-(methoxymethyl)-5-methylindole has a molecular weight of 175.23 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-5-methylindole is sourced from PubChem (CID 110831319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).