1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine

C7H9N5 — CID 112710701

IUPAC1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine
SMILESCNCc1nc2nnccc2[nH]1
InChIInChI=1S/C7H9N5/c1-8-4-6-10-5-2-3-9-12-7(5)11-6/h2-3,8H,4H2,1H3,(H,10,11,12)
InChIKeyZKMJLORNOFRIQD-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.07
Rot. Bonds2

About 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine

1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine (PubChem CID 112710701) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine
PubChem CID112710701
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine
SMILESCNCc1nc2nnccc2[nH]1
InChIInChI=1S/C7H9N5/c1-8-4-6-10-5-2-3-9-12-7(5)11-6/h2-3,8H,4H2,1H3,(H,10,11,12)
InChIKeyZKMJLORNOFRIQD-UHFFFAOYSA-N
XLogP0.07
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5H-imidazo[4,5-c]pyridazin-6-yl)acetic acid
CID 112710710
3-(5H-imidazo[4,5-c]pyridazin-6-yl)propanoic acid
CID 83857665
N-methyl-1-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methanamine
CID 63724851
1-(1H-benzimidazol-2-yl)-N-methylmethanamine;dihydrochloride
CID 13169407
1-(4,5-dimethyl-1H-benzimidazol-2-yl)-N-methylmethanamine
CID 84618784
[2-(methylaminomethyl)-3H-benzimidazol-5-yl]methanamine
CID 83949221
2-(anilinomethyl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821045
2-ethyl-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79821418
N,N-dimethyl-2-[(propan-2-ylamino)methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 79815352
N-methyl-1-(1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-yl)methanamine
CID 63927396
N-methyl-1-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)methanamine
CID 15851824
1-(2-ethyl-1H-benzimidazol-4-yl)-N-methylmethanamine
CID 83877191

Frequently Asked Questions

What is the IUPAC name of 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine?
The IUPAC name of 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine (CID 112710701) is 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine is CNCc1nc2nnccc2[nH]1.
What is the InChIKey of 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine?
The InChIKey is ZKMJLORNOFRIQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c1-8-4-6-10-5-2-3-9-12-7(5)11-6/h2-3,8H,4H2,1H3,(H,10,11,12).
What are the key properties of 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine?
1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine has a molecular weight of 163.18 g/mol, XLogP of 0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5H-imidazo[4,5-c]pyridazin-6-yl)-N-methylmethanamine is sourced from PubChem (CID 112710701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).