1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine

C13H18N2 — CID 117185713

IUPAC1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine
SMILESCCn1cc(CNC)c2ccc(C)cc21
InChIInChI=1S/C13H18N2/c1-4-15-9-11(8-14-3)12-6-5-10(2)7-13(12)15/h5-7,9,14H,4,8H2,1-3H3
InChIKeyBUIHIMZMYLUHSN-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.69
Rot. Bonds3

About 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine

1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine (PubChem CID 117185713) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine
PubChem CID117185713
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine
SMILESCCn1cc(CNC)c2ccc(C)cc21
InChIInChI=1S/C13H18N2/c1-4-15-9-11(8-14-3)12-6-5-10(2)7-13(12)15/h5-7,9,14H,4,8H2,1-3H3
InChIKeyBUIHIMZMYLUHSN-UHFFFAOYSA-N
XLogP2.69
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine (CID 117185713) is 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine is CCn1cc(CNC)c2ccc(C)cc21.
What is the InChIKey of 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine?
The InChIKey is BUIHIMZMYLUHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-4-15-9-11(8-14-3)12-6-5-10(2)7-13(12)15/h5-7,9,14H,4,8H2,1-3H3.
What are the key properties of 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine?
1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine has a molecular weight of 202.30 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-6-methylindol-3-yl)-N-methylmethanamine is sourced from PubChem (CID 117185713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).