(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride

C7H13Cl2N3 — CID 119031323

IUPAC(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride
SMILESCc1nncc(CN)c1C.Cl.Cl
InChIInChI=1S/C7H11N3.2ClH/c1-5-6(2)10-9-4-7(5)3-8;;/h4H,3,8H2,1-2H3;2*1H
InChIKeyBYSDRKJTZADEBX-UHFFFAOYSA-N
MW210.11 g/mol
LogP1.40
Rot. Bonds1

About (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride

(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride (PubChem CID 119031323) has the molecular formula C7H13Cl2N3 and a molecular weight of 210.11 g/mol. Its IUPAC name is (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride
PubChem CID119031323
Molecular FormulaC7H13Cl2N3
Molecular Weight210.11 g/mol
Exact Mass209.05
IUPAC Name(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride
SMILESCc1nncc(CN)c1C.Cl.Cl
InChIInChI=1S/C7H11N3.2ClH/c1-5-6(2)10-9-4-7(5)3-8;;/h4H,3,8H2,1-2H3;2*1H
InChIKeyBYSDRKJTZADEBX-UHFFFAOYSA-N
XLogP1.40
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.11
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride?
The IUPAC name of (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride (CID 119031323) is (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride.
What is the SMILES notation for (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride?
The canonical SMILES for (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride is Cc1nncc(CN)c1C.Cl.Cl.
What is the InChIKey of (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride?
The InChIKey is BYSDRKJTZADEBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3.2ClH/c1-5-6(2)10-9-4-7(5)3-8;;/h4H,3,8H2,1-2H3;2*1H.
What are the key properties of (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride?
(5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride has a molecular weight of 210.11 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5,6-dimethylpyridazin-4-yl)methanamine;dihydrochloride is sourced from PubChem (CID 119031323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).