N-methyl-1-(1-methylindol-4-yl)ethanamine

C12H16N2 — CID 115106916

IUPACN-methyl-1-(1-methylindol-4-yl)ethanamine
SMILESCNC(C)c1cccc2c1ccn2C
InChIInChI=1S/C12H16N2/c1-9(13-2)10-5-4-6-12-11(10)7-8-14(12)3/h4-9,13H,1-3H3
InChIKeyOAVAWDUERJDAQC-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.46
Rot. Bonds2

About N-methyl-1-(1-methylindol-4-yl)ethanamine

N-methyl-1-(1-methylindol-4-yl)ethanamine (PubChem CID 115106916) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-methyl-1-(1-methylindol-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylindol-4-yl)ethanamine
PubChem CID115106916
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC NameN-methyl-1-(1-methylindol-4-yl)ethanamine
SMILESCNC(C)c1cccc2c1ccn2C
InChIInChI=1S/C12H16N2/c1-9(13-2)10-5-4-6-12-11(10)7-8-14(12)3/h4-9,13H,1-3H3
InChIKeyOAVAWDUERJDAQC-UHFFFAOYSA-N
XLogP2.46
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-(1-methylindol-4-yl)propanoate
CID 102374940
N-tert-butyl-N-methyl-4-(1-methylindol-4-yl)pentan-1-amine
CID 58313534
4-chloro-1-methylindole;ethane
CID 142062846
bis(1-methylindol-4-yl)-diphenylphosphanium
CID 177284167
(1S)-1-(3-chloro-2-methylphenyl)-N-methylethanamine
CID 96656380
1-(7-bromo-1-methylindol-3-yl)-N-methylethanamine
CID 117197621
N,N-dimethyl-2-[3-methyl-3-(1-methylindol-4-yl)butan-2-yl]aniline
CID 131990127
(2R)-2-cyano-N-methyl-3-(1-methylindol-4-yl)-3-oxopropanamide
CID 98353290
(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine
CID 124705704
2-[(1S)-1-(methylamino)ethyl]benzenethiol
CID 131140509
1-methyl-4-propylindole
CID 59939717
1-(7-methoxy-1-methylindol-3-yl)-N-methylethanamine
CID 83860032

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylindol-4-yl)ethanamine?
The IUPAC name of N-methyl-1-(1-methylindol-4-yl)ethanamine (CID 115106916) is N-methyl-1-(1-methylindol-4-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(1-methylindol-4-yl)ethanamine?
The canonical SMILES for N-methyl-1-(1-methylindol-4-yl)ethanamine is CNC(C)c1cccc2c1ccn2C.
What is the InChIKey of N-methyl-1-(1-methylindol-4-yl)ethanamine?
The InChIKey is OAVAWDUERJDAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-9(13-2)10-5-4-6-12-11(10)7-8-14(12)3/h4-9,13H,1-3H3.
What are the key properties of N-methyl-1-(1-methylindol-4-yl)ethanamine?
N-methyl-1-(1-methylindol-4-yl)ethanamine has a molecular weight of 188.27 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylindol-4-yl)ethanamine is sourced from PubChem (CID 115106916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).