3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine

C13H19N3 — CID 176928919

IUPAC3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine
SMILESCc1ccc2c(c1)c(CCN)cn2N(C)C
InChIInChI=1S/C13H19N3/c1-10-4-5-13-12(8-10)11(6-7-14)9-16(13)15(2)3/h4-5,8-9H,6-7,14H2,1-3H3
InChIKeyFCFIEPSPFRKJJV-UHFFFAOYSA-N
MW217.32 g/mol
LogP1.65
Rot. Bonds3

About 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine

3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine (PubChem CID 176928919) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine.

Molecular Properties

Compound Name3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine
PubChem CID176928919
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine
SMILESCc1ccc2c(c1)c(CCN)cn2N(C)C
InChIInChI=1S/C13H19N3/c1-10-4-5-13-12(8-10)11(6-7-14)9-16(13)15(2)3/h4-5,8-9H,6-7,14H2,1-3H3
InChIKeyFCFIEPSPFRKJJV-UHFFFAOYSA-N
XLogP1.65
TPSA34.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,5-dimethylindol-3-yl)ethanamine;hydrochloride
CID 18933143
2-[3-(2-aminoethyl)-5-methylindol-1-yl]acetamide;hydrochloride
CID 155858615
2-(5-bromo-1-methylindol-3-yl)ethanamine
CID 71560076
3-(3,6-dimethylcarbazol-9-yl)propan-1-amine
CID 58183726
2-[5-methyl-3-(3-piperazin-1-ylpropyl)indol-1-yl]ethanamine
CID 83948925
2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine
CID 83918262
3-(2-isocyanoethyl)-1,5-dimethylindole
CID 83485144
2-(2-aminoethyl)-5-methylphenol
CID 55254754
3-(1-cyclopropyl-6-methylindol-3-yl)propan-1-amine
CID 115036861
2-(5-methyl-1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 60785148
3-(5-methyl-3-propan-2-ylindol-1-yl)propan-1-amine
CID 83948737
2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine
CID 83948286

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine?
The IUPAC name of 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine (CID 176928919) is 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine.
What is the SMILES notation for 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine?
The canonical SMILES for 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine is Cc1ccc2c(c1)c(CCN)cn2N(C)C.
What is the InChIKey of 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine?
The InChIKey is FCFIEPSPFRKJJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-10-4-5-13-12(8-10)11(6-7-14)9-16(13)15(2)3/h4-5,8-9H,6-7,14H2,1-3H3.
What are the key properties of 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine?
3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine has a molecular weight of 217.32 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine is sourced from PubChem (CID 176928919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).