N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine

C12H16N2 — CID 65333714

IUPACN-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine
SMILESCNC(C)c1cc2cccc(C)c2[nH]1
InChIInChI=1S/C12H16N2/c1-8-5-4-6-10-7-11(9(2)13-3)14-12(8)10/h4-7,9,13-14H,1-3H3
InChIKeyOCHIOTLVYNYUNW-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.76
Rot. Bonds2

About N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine

N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine (PubChem CID 65333714) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine
PubChem CID65333714
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC NameN-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine
SMILESCNC(C)c1cc2cccc(C)c2[nH]1
InChIInChI=1S/C12H16N2/c1-8-5-4-6-10-7-11(9(2)13-3)14-12(8)10/h4-7,9,13-14H,1-3H3
InChIKeyOCHIOTLVYNYUNW-UHFFFAOYSA-N
XLogP2.76
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine?
The IUPAC name of N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine (CID 65333714) is N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine?
The canonical SMILES for N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine is CNC(C)c1cc2cccc(C)c2[nH]1.
What is the InChIKey of N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine?
The InChIKey is OCHIOTLVYNYUNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-8-5-4-6-10-7-11(9(2)13-3)14-12(8)10/h4-7,9,13-14H,1-3H3.
What are the key properties of N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine?
N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine has a molecular weight of 188.27 g/mol, XLogP of 2.76, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(7-methyl-1H-indol-2-yl)ethanamine is sourced from PubChem (CID 65333714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).