[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine

C14H15N3 — CID 82287618

IUPAC[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine
SMILESNCc1ccc(-c2ccc3c(c2)CCC3)nn1
InChIInChI=1S/C14H15N3/c15-9-13-6-7-14(17-16-13)12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9,15H2
InChIKeyBOCZOGFZVHVHRR-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.09
Rot. Bonds2

About [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine

[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine (PubChem CID 82287618) has the molecular formula C14H15N3 and a molecular weight of 225.29 g/mol. Its IUPAC name is [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine
PubChem CID82287618
Molecular FormulaC14H15N3
Molecular Weight225.29 g/mol
Exact Mass225.13
IUPAC Name[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine
SMILESNCc1ccc(-c2ccc3c(c2)CCC3)nn1
InChIInChI=1S/C14H15N3/c15-9-13-6-7-14(17-16-13)12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9,15H2
InChIKeyBOCZOGFZVHVHRR-UHFFFAOYSA-N
XLogP2.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine?
The IUPAC name of [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine (CID 82287618) is [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine is NCc1ccc(-c2ccc3c(c2)CCC3)nn1.
What is the InChIKey of [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine?
The InChIKey is BOCZOGFZVHVHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3/c15-9-13-6-7-14(17-16-13)12-5-4-10-2-1-3-11(10)8-12/h4-8H,1-3,9,15H2.
What are the key properties of [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine?
[6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine has a molecular weight of 225.29 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3-dihydro-1H-inden-5-yl)pyridazin-3-yl]methanamine is sourced from PubChem (CID 82287618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).