1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine

C12H16N2 — CID 82490825

IUPAC1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine
SMILESCCc1ccc2[nH]cc(CNC)c2c1
InChIInChI=1S/C12H16N2/c1-3-9-4-5-12-11(6-9)10(7-13-2)8-14-12/h4-6,8,13-14H,3,7H2,1-2H3
InChIKeyJIRVPAZGACRYKB-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.45
Rot. Bonds3

About 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine

1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine (PubChem CID 82490825) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine
PubChem CID82490825
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine
SMILESCCc1ccc2[nH]cc(CNC)c2c1
InChIInChI=1S/C12H16N2/c1-3-9-4-5-12-11(6-9)10(7-13-2)8-14-12/h4-6,8,13-14H,3,7H2,1-2H3
InChIKeyJIRVPAZGACRYKB-UHFFFAOYSA-N
XLogP2.45
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(methylaminomethyl)-1H-indol-6-yl]methanamine
CID 117178238
1-(3-bromo-5-ethyl-1H-indol-2-yl)-N-methylmethanamine
CID 84640380
1-(5-ethyl-1H-indol-3-yl)-2-(methylamino)ethanone
CID 82493050
1-[2-(5-ethyl-1H-indol-3-yl)ethyl]cyclopropan-1-amine
CID 105486018
N-methyl-1-(6-methyl-1H-indol-3-yl)methanamine
CID 68579797
N,N-dibenzyl-2-(5-ethyl-1H-indol-3-yl)ethanamine
CID 175502813
N-[(5-ethyl-1H-indol-3-yl)methoxy]cyclopropanecarboxamide
CID 19967260
N-[(3-propyl-1H-indol-5-yl)methyl]methanesulfonamide
CID 174336078
5-ethyl-2-(methylaminomethyl)benzaldehyde
CID 143512508
5-ethyl-1H-indole-3-sulfonyl chloride
CID 82374069
N-[(5-methoxy-1H-indol-3-yl)methyl]-2-(4-methoxyphenyl)ethanamine
CID 53274281
1-[6-[(2,3-difluoro-4-methylphenyl)methyl]-1H-indol-3-yl]-N-methylmethanamine
CID 134357248

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine (CID 82490825) is 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine is CCc1ccc2[nH]cc(CNC)c2c1.
What is the InChIKey of 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine?
The InChIKey is JIRVPAZGACRYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-3-9-4-5-12-11(6-9)10(7-13-2)8-14-12/h4-6,8,13-14H,3,7H2,1-2H3.
What are the key properties of 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine?
1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine has a molecular weight of 188.27 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1H-indol-3-yl)-N-methylmethanamine is sourced from PubChem (CID 82490825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).