(6-methoxy-4-methyl-1H-indol-3-yl)methanamine

C11H14N2O — CID 83877465

IUPAC(6-methoxy-4-methyl-1H-indol-3-yl)methanamine
SMILESCOc1cc(C)c2c(CN)c[nH]c2c1
InChIInChI=1S/C11H14N2O/c1-7-3-9(14-2)4-10-11(7)8(5-12)6-13-10/h3-4,6,13H,5,12H2,1-2H3
InChIKeyRSJKGQDVHUTPIS-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.94
Rot. Bonds2

About (6-methoxy-4-methyl-1H-indol-3-yl)methanamine

(6-methoxy-4-methyl-1H-indol-3-yl)methanamine (PubChem CID 83877465) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is (6-methoxy-4-methyl-1H-indol-3-yl)methanamine.

Molecular Properties

Compound Name(6-methoxy-4-methyl-1H-indol-3-yl)methanamine
PubChem CID83877465
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name(6-methoxy-4-methyl-1H-indol-3-yl)methanamine
SMILESCOc1cc(C)c2c(CN)c[nH]c2c1
InChIInChI=1S/C11H14N2O/c1-7-3-9(14-2)4-10-11(7)8(5-12)6-13-10/h3-4,6,13H,5,12H2,1-2H3
InChIKeyRSJKGQDVHUTPIS-UHFFFAOYSA-N
XLogP1.94
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-methoxy-4-methyl-1H-indol-3-yl)methanamine?
The IUPAC name of (6-methoxy-4-methyl-1H-indol-3-yl)methanamine (CID 83877465) is (6-methoxy-4-methyl-1H-indol-3-yl)methanamine.
What is the SMILES notation for (6-methoxy-4-methyl-1H-indol-3-yl)methanamine?
The canonical SMILES for (6-methoxy-4-methyl-1H-indol-3-yl)methanamine is COc1cc(C)c2c(CN)c[nH]c2c1.
What is the InChIKey of (6-methoxy-4-methyl-1H-indol-3-yl)methanamine?
The InChIKey is RSJKGQDVHUTPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-7-3-9(14-2)4-10-11(7)8(5-12)6-13-10/h3-4,6,13H,5,12H2,1-2H3.
What are the key properties of (6-methoxy-4-methyl-1H-indol-3-yl)methanamine?
(6-methoxy-4-methyl-1H-indol-3-yl)methanamine has a molecular weight of 190.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-4-methyl-1H-indol-3-yl)methanamine is sourced from PubChem (CID 83877465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).