4H-indol-3-amine

C8H8N2 — CID 174509909

IUPAC4H-indol-3-amine
SMILESNC1=C2CC=CC=C2N=C1
InChIInChI=1S/C8H8N2/c9-7-5-10-8-4-2-1-3-6(7)8/h1-2,4-5H,3,9H2
InChIKeyARYZUCVWIXZZDR-UHFFFAOYSA-N
MW132.17 g/mol
LogP1.13
Rot. Bonds

About 4H-indol-3-amine

4H-indol-3-amine (PubChem CID 174509909) has the molecular formula C8H8N2 and a molecular weight of 132.17 g/mol. Its IUPAC name is 4H-indol-3-amine.

Molecular Properties

Compound Name4H-indol-3-amine
PubChem CID174509909
Molecular FormulaC8H8N2
Molecular Weight132.17 g/mol
Exact Mass132.07
IUPAC Name4H-indol-3-amine
SMILESNC1=C2CC=CC=C2N=C1
InChIInChI=1S/C8H8N2/c9-7-5-10-8-4-2-1-3-6(7)8/h1-2,4-5H,3,9H2
InChIKeyARYZUCVWIXZZDR-UHFFFAOYSA-N
XLogP1.13
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4H-indol-3-amine?
The IUPAC name of 4H-indol-3-amine (CID 174509909) is 4H-indol-3-amine.
What is the SMILES notation for 4H-indol-3-amine?
The canonical SMILES for 4H-indol-3-amine is NC1=C2CC=CC=C2N=C1.
What is the InChIKey of 4H-indol-3-amine?
The InChIKey is ARYZUCVWIXZZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2/c9-7-5-10-8-4-2-1-3-6(7)8/h1-2,4-5H,3,9H2.
What are the key properties of 4H-indol-3-amine?
4H-indol-3-amine has a molecular weight of 132.17 g/mol, XLogP of 1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-indol-3-amine is sourced from PubChem (CID 174509909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).