(6-methylpyridazin-3-yl)methanamine;dihydrochloride

C6H11Cl2N3 — CID 91667906

IUPAC(6-methylpyridazin-3-yl)methanamine;dihydrochloride
SMILESCc1ccc(CN)nn1.Cl.Cl
InChIInChI=1S/C6H9N3.2ClH/c1-5-2-3-6(4-7)9-8-5;;/h2-3H,4,7H2,1H3;2*1H
InChIKeyDHHBGVAVHZOVNW-UHFFFAOYSA-N
MW196.08 g/mol
LogP1.09
Rot. Bonds1

About (6-methylpyridazin-3-yl)methanamine;dihydrochloride

(6-methylpyridazin-3-yl)methanamine;dihydrochloride (PubChem CID 91667906) has the molecular formula C6H11Cl2N3 and a molecular weight of 196.08 g/mol. Its IUPAC name is (6-methylpyridazin-3-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(6-methylpyridazin-3-yl)methanamine;dihydrochloride
PubChem CID91667906
Molecular FormulaC6H11Cl2N3
Molecular Weight196.08 g/mol
Exact Mass195.03
IUPAC Name(6-methylpyridazin-3-yl)methanamine;dihydrochloride
SMILESCc1ccc(CN)nn1.Cl.Cl
InChIInChI=1S/C6H9N3.2ClH/c1-5-2-3-6(4-7)9-8-5;;/h2-3H,4,7H2,1H3;2*1H
InChIKeyDHHBGVAVHZOVNW-UHFFFAOYSA-N
XLogP1.09
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.08
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-methylpyridazin-3-yl)methanamine;dihydrochloride?
The IUPAC name of (6-methylpyridazin-3-yl)methanamine;dihydrochloride (CID 91667906) is (6-methylpyridazin-3-yl)methanamine;dihydrochloride.
What is the SMILES notation for (6-methylpyridazin-3-yl)methanamine;dihydrochloride?
The canonical SMILES for (6-methylpyridazin-3-yl)methanamine;dihydrochloride is Cc1ccc(CN)nn1.Cl.Cl.
What is the InChIKey of (6-methylpyridazin-3-yl)methanamine;dihydrochloride?
The InChIKey is DHHBGVAVHZOVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3.2ClH/c1-5-2-3-6(4-7)9-8-5;;/h2-3H,4,7H2,1H3;2*1H.
What are the key properties of (6-methylpyridazin-3-yl)methanamine;dihydrochloride?
(6-methylpyridazin-3-yl)methanamine;dihydrochloride has a molecular weight of 196.08 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylpyridazin-3-yl)methanamine;dihydrochloride is sourced from PubChem (CID 91667906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).