1-ethylindol-6-amine

C10H12N2 — CID 22329429

IUPAC1-ethylindol-6-amine
SMILESCCn1ccc2ccc(N)cc21
InChIInChI=1S/C10H12N2/c1-2-12-6-5-8-3-4-9(11)7-10(8)12/h3-7H,2,11H2,1H3
InChIKeyMDHUYIXJXAQMAP-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.24
Rot. Bonds1

About 1-ethylindol-6-amine

1-ethylindol-6-amine (PubChem CID 22329429) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 1-ethylindol-6-amine.

Molecular Properties

Compound Name1-ethylindol-6-amine
PubChem CID22329429
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name1-ethylindol-6-amine
SMILESCCn1ccc2ccc(N)cc21
InChIInChI=1S/C10H12N2/c1-2-12-6-5-8-3-4-9(11)7-10(8)12/h3-7H,2,11H2,1H3
InChIKeyMDHUYIXJXAQMAP-UHFFFAOYSA-N
XLogP2.24
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-ethylindol-6-amine?
The IUPAC name of 1-ethylindol-6-amine (CID 22329429) is 1-ethylindol-6-amine.
What is the SMILES notation for 1-ethylindol-6-amine?
The canonical SMILES for 1-ethylindol-6-amine is CCn1ccc2ccc(N)cc21.
What is the InChIKey of 1-ethylindol-6-amine?
The InChIKey is MDHUYIXJXAQMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-2-12-6-5-8-3-4-9(11)7-10(8)12/h3-7H,2,11H2,1H3.
What are the key properties of 1-ethylindol-6-amine?
1-ethylindol-6-amine has a molecular weight of 160.22 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylindol-6-amine is sourced from PubChem (CID 22329429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).