[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine

C14H14N4 — CID 82292200

IUPAC[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine
SMILESCc1[nH]c2ccccc2c1-c1ccc(CN)nn1
InChIInChI=1S/C14H14N4/c1-9-14(11-4-2-3-5-12(11)16-9)13-7-6-10(8-15)17-18-13/h2-7,16H,8,15H2,1H3
InChIKeyHHBRGELTPBIFNV-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.39
Rot. Bonds2

About [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine

[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine (PubChem CID 82292200) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine
PubChem CID82292200
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine
SMILESCc1[nH]c2ccccc2c1-c1ccc(CN)nn1
InChIInChI=1S/C14H14N4/c1-9-14(11-4-2-3-5-12(11)16-9)13-7-6-10(8-15)17-18-13/h2-7,16H,8,15H2,1H3
InChIKeyHHBRGELTPBIFNV-UHFFFAOYSA-N
XLogP2.39
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine?
The IUPAC name of [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine (CID 82292200) is [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine is Cc1[nH]c2ccccc2c1-c1ccc(CN)nn1.
What is the InChIKey of [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine?
The InChIKey is HHBRGELTPBIFNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-14(11-4-2-3-5-12(11)16-9)13-7-6-10(8-15)17-18-13/h2-7,16H,8,15H2,1H3.
What are the key properties of [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine?
[6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine has a molecular weight of 238.29 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methyl-1H-indol-3-yl)pyridazin-3-yl]methanamine is sourced from PubChem (CID 82292200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).