(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine

C13H18N2 — CID 124705704

IUPAC(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine
SMILESCCn1cc([C@H](C)NC)c2ccccc21
InChIInChI=1S/C13H18N2/c1-4-15-9-12(10(2)14-3)11-7-5-6-8-13(11)15/h5-10,14H,4H2,1-3H3/t10-/m0/s1
InChIKeyDHBXLKMMIQUFRS-JTQLQIEISA-N
MW202.30 g/mol
LogP2.94
Rot. Bonds3

About (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine

(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine (PubChem CID 124705704) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine
PubChem CID124705704
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine
SMILESCCn1cc([C@H](C)NC)c2ccccc21
InChIInChI=1S/C13H18N2/c1-4-15-9-12(10(2)14-3)11-7-5-6-8-13(11)15/h5-10,14H,4H2,1-3H3/t10-/m0/s1
InChIKeyDHBXLKMMIQUFRS-JTQLQIEISA-N
XLogP2.94
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 ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-ethyl-6-methylindol-3-yl)-N-methylethanamine
CID 117196201
2-(1-ethylindol-3-yl)propanedioyl dichloride
CID 156786457
(2S)-2-(1-ethylindol-3-yl)butanedioic acid
CID 1096245
1-(1-ethylindol-3-yl)propan-2-amine
CID 6484661
4-[(1-ethylindol-3-yl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one
CID 3155995
1-ethyl-3-phenylsulfanylindole
CID 126489260
2-(1-ethylindol-3-yl)-2-thiophen-2-ylethanamine
CID 83987665
tris(1-ethylindol-3-yl)methanol
CID 142757847
2-(1-ethylindol-3-yl)-2-(1-ethylpiperidin-4-yl)ethanamine
CID 83976864
1-prop-2-enyl-3-[1-(1-prop-2-enylindol-3-yl)ethyl]indole
CID 135029119
(2R)-2-[[2-(1-ethylindol-3-yl)acetyl]amino]propanoic acid
CID 119244285
2-(1-ethylindol-3-yl)-2-(3-methylphenyl)ethanamine
CID 53213705

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine?
The IUPAC name of (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine (CID 124705704) is (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine.
What is the SMILES notation for (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine?
The canonical SMILES for (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine is CCn1cc([C@H](C)NC)c2ccccc21.
What is the InChIKey of (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine?
The InChIKey is DHBXLKMMIQUFRS-JTQLQIEISA-N. The full InChI is InChI=1S/C13H18N2/c1-4-15-9-12(10(2)14-3)11-7-5-6-8-13(11)15/h5-10,14H,4H2,1-3H3/t10-/m0/s1.
What are the key properties of (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine?
(1S)-1-(1-ethylindol-3-yl)-N-methylethanamine has a molecular weight of 202.30 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(1-ethylindol-3-yl)-N-methylethanamine is sourced from PubChem (CID 124705704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).