N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine

C11H14N2 — CID 117205001

IUPACN-methyl-1-(3-methyl-1H-indol-6-yl)methanamine
SMILESCNCc1ccc2c(C)c[nH]c2c1
InChIInChI=1S/C11H14N2/c1-8-6-13-11-5-9(7-12-2)3-4-10(8)11/h3-6,12-13H,7H2,1-2H3
InChIKeyHYCKDEWKXUPKOY-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.20
Rot. Bonds2

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

N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine (PubChem CID 117205001) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methyl-1H-indol-6-yl)methanamine
PubChem CID117205001
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC NameN-methyl-1-(3-methyl-1H-indol-6-yl)methanamine
SMILESCNCc1ccc2c(C)c[nH]c2c1
InChIInChI=1S/C11H14N2/c1-8-6-13-11-5-9(7-12-2)3-4-10(8)11/h3-6,12-13H,7H2,1-2H3
InChIKeyHYCKDEWKXUPKOY-UHFFFAOYSA-N
XLogP2.20
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine (CID 117205001) is N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine is CNCc1ccc2c(C)c[nH]c2c1.
What is the InChIKey of N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine?
The InChIKey is HYCKDEWKXUPKOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8-6-13-11-5-9(7-12-2)3-4-10(8)11/h3-6,12-13H,7H2,1-2H3.
What are the key properties of N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine?
N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine has a molecular weight of 174.25 g/mol, XLogP of 2.20, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methyl-1H-indol-6-yl)methanamine is sourced from PubChem (CID 117205001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).