5,7-dimethoxy-1H-indol-3-amine

C10H12N2O2 — CID 82402843

IUPAC5,7-dimethoxy-1H-indol-3-amine
SMILESCOc1cc(OC)c2[nH]cc(N)c2c1
InChIInChI=1S/C10H12N2O2/c1-13-6-3-7-8(11)5-12-10(7)9(4-6)14-2/h3-5,12H,11H2,1-2H3
InChIKeyPXBYJMLPCILQAC-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.77
Rot. Bonds2

About 5,7-dimethoxy-1H-indol-3-amine

5,7-dimethoxy-1H-indol-3-amine (PubChem CID 82402843) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 5,7-dimethoxy-1H-indol-3-amine.

Molecular Properties

Compound Name5,7-dimethoxy-1H-indol-3-amine
PubChem CID82402843
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name5,7-dimethoxy-1H-indol-3-amine
SMILESCOc1cc(OC)c2[nH]cc(N)c2c1
InChIInChI=1S/C10H12N2O2/c1-13-6-3-7-8(11)5-12-10(7)9(4-6)14-2/h3-5,12H,11H2,1-2H3
InChIKeyPXBYJMLPCILQAC-UHFFFAOYSA-N
XLogP1.77
TPSA60.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethoxy-1H-indol-3-amine?
The IUPAC name of 5,7-dimethoxy-1H-indol-3-amine (CID 82402843) is 5,7-dimethoxy-1H-indol-3-amine.
What is the SMILES notation for 5,7-dimethoxy-1H-indol-3-amine?
The canonical SMILES for 5,7-dimethoxy-1H-indol-3-amine is COc1cc(OC)c2[nH]cc(N)c2c1.
What is the InChIKey of 5,7-dimethoxy-1H-indol-3-amine?
The InChIKey is PXBYJMLPCILQAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-13-6-3-7-8(11)5-12-10(7)9(4-6)14-2/h3-5,12H,11H2,1-2H3.
What are the key properties of 5,7-dimethoxy-1H-indol-3-amine?
5,7-dimethoxy-1H-indol-3-amine has a molecular weight of 192.22 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethoxy-1H-indol-3-amine is sourced from PubChem (CID 82402843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).