2-(1H-indol-2-yl)ethanamine;hydroiodide

C10H13IN2 — CID 175201769

IUPAC2-(1H-indol-2-yl)ethanamine;hydroiodide
SMILESI.NCCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H12N2.HI/c11-6-5-9-7-8-3-1-2-4-10(8)12-9;/h1-4,7,12H,5-6,11H2;1H
InChIKeyRNLKOUQHEWZXAR-UHFFFAOYSA-N
MW288.13 g/mol
LogP2.29
Rot. Bonds2

About 2-(1H-indol-2-yl)ethanamine;hydroiodide

2-(1H-indol-2-yl)ethanamine;hydroiodide (PubChem CID 175201769) has the molecular formula C10H13IN2 and a molecular weight of 288.13 g/mol. Its IUPAC name is 2-(1H-indol-2-yl)ethanamine;hydroiodide.

Molecular Properties

Compound Name2-(1H-indol-2-yl)ethanamine;hydroiodide
PubChem CID175201769
Molecular FormulaC10H13IN2
Molecular Weight288.13 g/mol
Exact Mass288.01
IUPAC Name2-(1H-indol-2-yl)ethanamine;hydroiodide
SMILESI.NCCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H12N2.HI/c11-6-5-9-7-8-3-1-2-4-10(8)12-9;/h1-4,7,12H,5-6,11H2;1H
InChIKeyRNLKOUQHEWZXAR-UHFFFAOYSA-N
XLogP2.29
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.13
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(2-fluoroethyl)-1H-indole
CID 142633825
2-(3-chloropropyl)-1H-indole
CID 13271043
4-(1H-indol-2-yl)-2-methylbutan-2-amine
CID 116995131
2-heptyl-1H-indole
CID 3719004
2-hexyl-1H-indole
CID 14299246
2-(2-pyridin-4-ylethyl)-1H-indole
CID 10421101
4-(1H-indol-2-yl)butan-2-one
CID 10954278
1-(1H-indol-2-yl)butan-2-amine
CID 54026892
2-[2-(4-bromophenyl)ethyl]-1H-indole
CID 144993439
2-(4-methylpentyl)-1H-indole
CID 18761636
2-(1H-indol-2-yl)-N-methoxyethanamine
CID 154141059
2-(4-fluoropentyl)-1H-indole
CID 170987599

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-2-yl)ethanamine;hydroiodide?
The IUPAC name of 2-(1H-indol-2-yl)ethanamine;hydroiodide (CID 175201769) is 2-(1H-indol-2-yl)ethanamine;hydroiodide.
What is the SMILES notation for 2-(1H-indol-2-yl)ethanamine;hydroiodide?
The canonical SMILES for 2-(1H-indol-2-yl)ethanamine;hydroiodide is I.NCCc1cc2ccccc2[nH]1.
What is the InChIKey of 2-(1H-indol-2-yl)ethanamine;hydroiodide?
The InChIKey is RNLKOUQHEWZXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2.HI/c11-6-5-9-7-8-3-1-2-4-10(8)12-9;/h1-4,7,12H,5-6,11H2;1H.
What are the key properties of 2-(1H-indol-2-yl)ethanamine;hydroiodide?
2-(1H-indol-2-yl)ethanamine;hydroiodide has a molecular weight of 288.13 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-2-yl)ethanamine;hydroiodide is sourced from PubChem (CID 175201769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).