5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole

C15H19NO2 — CID 101448637

IUPAC5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole
SMILESCOc1ccc2c(c1)c(C1(C)CCCO1)cn2C
InChIInChI=1S/C15H19NO2/c1-15(7-4-8-18-15)13-10-16(2)14-6-5-11(17-3)9-12(13)14/h5-6,9-10H,4,7-8H2,1-3H3
InChIKeyQJYMNRVQHOSCGK-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.21
Rot. Bonds2

About 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole

5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole (PubChem CID 101448637) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole.

Molecular Properties

Compound Name5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole
PubChem CID101448637
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole
SMILESCOc1ccc2c(c1)c(C1(C)CCCO1)cn2C
InChIInChI=1S/C15H19NO2/c1-15(7-4-8-18-15)13-10-16(2)14-6-5-11(17-3)9-12(13)14/h5-6,9-10H,4,7-8H2,1-3H3
InChIKeyQJYMNRVQHOSCGK-UHFFFAOYSA-N
XLogP3.21
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole?
The IUPAC name of 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole (CID 101448637) is 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole.
What is the SMILES notation for 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole?
The canonical SMILES for 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole is COc1ccc2c(c1)c(C1(C)CCCO1)cn2C.
What is the InChIKey of 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole?
The InChIKey is QJYMNRVQHOSCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-15(7-4-8-18-15)13-10-16(2)14-6-5-11(17-3)9-12(13)14/h5-6,9-10H,4,7-8H2,1-3H3.
What are the key properties of 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole?
5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole has a molecular weight of 245.32 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-3-(2-methyloxolan-2-yl)indole is sourced from PubChem (CID 101448637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).