4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine

C8H11N3 — CID 131187843

IUPAC4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
SMILESCc1cnnc2c1CNCC2
InChIInChI=1S/C8H11N3/c1-6-4-10-11-8-2-3-9-5-7(6)8/h4,9H,2-3,5H2,1H3
InChIKeyKYOBJYVWVDPLPF-UHFFFAOYSA-N
MW149.20 g/mol
LogP0.43
Rot. Bonds

About 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine

4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine (PubChem CID 131187843) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine.

Molecular Properties

Compound Name4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
PubChem CID131187843
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
SMILESCc1cnnc2c1CNCC2
InChIInChI=1S/C8H11N3/c1-6-4-10-11-8-2-3-9-5-7(6)8/h4,9H,2-3,5H2,1H3
InChIKeyKYOBJYVWVDPLPF-UHFFFAOYSA-N
XLogP0.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-Bis(trifluoromethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyridazine
CID 134869364
5h,6h,7h,8h-Pyrido[4,3-c]pyridazine
CID 19761172
5H,6H,7H,8H-pyrido(4,3-c)pyridazine dihydrochloride
CID 137945026
(5,6-Dimethylpyridazin-4-yl)methanamine
CID 119031324
3-(Piperidin-4-yl)pyridazine
CID 53883965
N-[[6-(trifluoromethyl)pyridazin-4-yl]methyl]ethanamine
CID 68357587
4-Piperidin-4-yl-3-(trifluoromethyl)pyridazine;hydrochloride
CID 139510206
4-Piperidin-4-yl-3-(trifluoromethyl)pyridazine
CID 139510207
Aminomethyldiethyldiazine
CID 129853032
1-Ethyl-5,6,7,8-tetrahydrophthalazine
CID 21300331
3-Chloro-4,8-dimethyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
CID 23464667
3-Chloro-4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine
CID 23464684

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine?
The IUPAC name of 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine (CID 131187843) is 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine.
What is the SMILES notation for 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine?
The canonical SMILES for 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine is Cc1cnnc2c1CNCC2.
What is the InChIKey of 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine?
The InChIKey is KYOBJYVWVDPLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-6-4-10-11-8-2-3-9-5-7(6)8/h4,9H,2-3,5H2,1H3.
What are the key properties of 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine?
4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine has a molecular weight of 149.20 g/mol, XLogP of 0.43, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine is sourced from PubChem (CID 131187843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).