3-(2-aminoethyl)-2H-indol-5-amine

C10H13N3 — CID 124517523

IUPAC3-(2-aminoethyl)-2H-indol-5-amine
SMILESNCCC1=c2cc(N)ccc2=NC1
InChIInChI=1S/C10H13N3/c11-4-3-7-6-13-10-2-1-8(12)5-9(7)10/h1-2,5H,3-4,6,11-12H2
InChIKeyBEABQBGVDTYUCS-UHFFFAOYSA-N
MW175.24 g/mol
LogP-0.60
Rot. Bonds2

About 3-(2-aminoethyl)-2H-indol-5-amine

3-(2-aminoethyl)-2H-indol-5-amine (PubChem CID 124517523) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is 3-(2-aminoethyl)-2H-indol-5-amine.

Molecular Properties

Compound Name3-(2-aminoethyl)-2H-indol-5-amine
PubChem CID124517523
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name3-(2-aminoethyl)-2H-indol-5-amine
SMILESNCCC1=c2cc(N)ccc2=NC1
InChIInChI=1S/C10H13N3/c11-4-3-7-6-13-10-2-1-8(12)5-9(7)10/h1-2,5H,3-4,6,11-12H2
InChIKeyBEABQBGVDTYUCS-UHFFFAOYSA-N
XLogP-0.60
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-2H-indol-5-amine?
The IUPAC name of 3-(2-aminoethyl)-2H-indol-5-amine (CID 124517523) is 3-(2-aminoethyl)-2H-indol-5-amine.
What is the SMILES notation for 3-(2-aminoethyl)-2H-indol-5-amine?
The canonical SMILES for 3-(2-aminoethyl)-2H-indol-5-amine is NCCC1=c2cc(N)ccc2=NC1.
What is the InChIKey of 3-(2-aminoethyl)-2H-indol-5-amine?
The InChIKey is BEABQBGVDTYUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c11-4-3-7-6-13-10-2-1-8(12)5-9(7)10/h1-2,5H,3-4,6,11-12H2.
What are the key properties of 3-(2-aminoethyl)-2H-indol-5-amine?
3-(2-aminoethyl)-2H-indol-5-amine has a molecular weight of 175.24 g/mol, XLogP of -0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-2H-indol-5-amine is sourced from PubChem (CID 124517523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).