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

C15H20N2O — CID 82664697

IUPAC5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole
SMILESCOc1ccc2c(c1)c(C1(C)CCCN1)cn2C
InChIInChI=1S/C15H20N2O/c1-15(7-4-8-16-15)13-10-17(2)14-6-5-11(18-3)9-12(13)14/h5-6,9-10,16H,4,7-8H2,1-3H3
InChIKeyBKCFBNXIQCUFPO-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.79
Rot. Bonds2

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

5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole (PubChem CID 82664697) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole.

Molecular Properties

Compound Name5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole
PubChem CID82664697
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole
SMILESCOc1ccc2c(c1)c(C1(C)CCCN1)cn2C
InChIInChI=1S/C15H20N2O/c1-15(7-4-8-16-15)13-10-17(2)14-6-5-11(18-3)9-12(13)14/h5-6,9-10,16H,4,7-8H2,1-3H3
InChIKeyBKCFBNXIQCUFPO-UHFFFAOYSA-N
XLogP2.79
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-(2-fluoro-5-methoxyphenyl)-2-methylpyrrolidine
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2-(5-methoxy-2-pyrrolidin-1-ylphenyl)-2-methylpyrrolidine
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4-methoxy-N,N-dimethyl-2-(2-methylpyrrolidin-2-yl)aniline
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2-(4-methoxy-2-methylphenyl)-2-methylazepane
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2-methoxy-5-methyl-7-(2-methylpyrrolidin-2-yl)pyrrolo[2,3-b]pyrazine
CID 82665045
5-methoxy-1-methyl-4-(2-methylpyrrolidin-2-yl)pyrazole
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3-bromo-5-methoxy-1-methylindole
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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole?
The IUPAC name of 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole (CID 82664697) is 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole.
What is the SMILES notation for 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole?
The canonical SMILES for 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole is COc1ccc2c(c1)c(C1(C)CCCN1)cn2C.
What is the InChIKey of 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole?
The InChIKey is BKCFBNXIQCUFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-15(7-4-8-16-15)13-10-17(2)14-6-5-11(18-3)9-12(13)14/h5-6,9-10,16H,4,7-8H2,1-3H3.
What are the key properties of 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole?
5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole has a molecular weight of 244.34 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-3-(2-methylpyrrolidin-2-yl)indole is sourced from PubChem (CID 82664697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).