1,2,3,5-tetramethylindol-6-amine

C12H16N2 — CID 15758362

IUPAC1,2,3,5-tetramethylindol-6-amine
SMILESCc1cc2c(C)c(C)n(C)c2cc1N
InChIInChI=1S/C12H16N2/c1-7-5-10-8(2)9(3)14(4)12(10)6-11(7)13/h5-6H,13H2,1-4H3
InChIKeyLVCRNOMQIGBNBT-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.69
Rot. Bonds

About 1,2,3,5-tetramethylindol-6-amine

1,2,3,5-tetramethylindol-6-amine (PubChem CID 15758362) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1,2,3,5-tetramethylindol-6-amine.

Molecular Properties

Compound Name1,2,3,5-tetramethylindol-6-amine
PubChem CID15758362
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name1,2,3,5-tetramethylindol-6-amine
SMILESCc1cc2c(C)c(C)n(C)c2cc1N
InChIInChI=1S/C12H16N2/c1-7-5-10-8(2)9(3)14(4)12(10)6-11(7)13/h5-6H,13H2,1-4H3
InChIKeyLVCRNOMQIGBNBT-UHFFFAOYSA-N
XLogP2.69
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetramethylindol-6-amine?
The IUPAC name of 1,2,3,5-tetramethylindol-6-amine (CID 15758362) is 1,2,3,5-tetramethylindol-6-amine.
What is the SMILES notation for 1,2,3,5-tetramethylindol-6-amine?
The canonical SMILES for 1,2,3,5-tetramethylindol-6-amine is Cc1cc2c(C)c(C)n(C)c2cc1N.
What is the InChIKey of 1,2,3,5-tetramethylindol-6-amine?
The InChIKey is LVCRNOMQIGBNBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-7-5-10-8(2)9(3)14(4)12(10)6-11(7)13/h5-6H,13H2,1-4H3.
What are the key properties of 1,2,3,5-tetramethylindol-6-amine?
1,2,3,5-tetramethylindol-6-amine has a molecular weight of 188.27 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetramethylindol-6-amine is sourced from PubChem (CID 15758362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).