3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine

C8H10ClN3 — CID 62783672

IUPAC3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine
SMILESCN1CCc2nnc(Cl)cc2C1
InChIInChI=1S/C8H10ClN3/c1-12-3-2-7-6(5-12)4-8(9)11-10-7/h4H,2-3,5H2,1H3
InChIKeyVQHJNKZJJQLGKM-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.12
Rot. Bonds

About 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine

3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine (PubChem CID 62783672) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine.

Molecular Properties

Compound Name3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine
PubChem CID62783672
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine
SMILESCN1CCc2nnc(Cl)cc2C1
InChIInChI=1S/C8H10ClN3/c1-12-3-2-7-6(5-12)4-8(9)11-10-7/h4H,2-3,5H2,1H3
InChIKeyVQHJNKZJJQLGKM-UHFFFAOYSA-N
XLogP1.12
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 3-chloro-5H,6H,7H,8H-pyrido(4,3-c)pyridazine-6-carboxylate
CID 12582766
3-Chloro-5,6,7,8-tetrahydrocinnoline
CID 14363916
methyl 3-chloro-5H,6H,7H,8H-pyrido[4,3-c]pyridazine-6-carboxylate
CID 53791974
3-chloro-5H,6H,7H,8H-pyrido(3,4-c)pyridazine hydrochloride
CID 86346446
3-Chloro-5,6,7,8-tetrahydropyrido[4,3-C]pyridazine
CID 12582764
3-Chloro-5,6,7,8-tetrahydropyrido[3,4-C]pyridazine
CID 45789678
(E)-N-[(6-chloro-4-ethylpyridazin-3-yl)methyl]-1-(3-fluorophenyl)-N-[(Z)-prop-1-enyl]but-1-en-1-amine
CID 142880007
1-(3-chloro-6,8-dihydro-5H-pyrido[3,4-c]pyridazin-7-yl)-2-fluoroethanone
CID 156864921
3-Chloro-4-ethyl-6-methylpyridazine
CID 15054344
N-[(6-chloropyridazin-3-yl)methyl]-1-(3-fluorophenyl)-N-methylmethanamine
CID 104513498
1-(6-chloropyridazin-3-yl)-N-[(2-fluorophenyl)methyl]-N-methylmethanamine
CID 104513567
N-[(6-chloropyridazin-3-yl)methyl]-1-(4-fluorophenyl)-N-methylmethanamine
CID 104513568

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine?
The IUPAC name of 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine (CID 62783672) is 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine.
What is the SMILES notation for 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine?
The canonical SMILES for 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine is CN1CCc2nnc(Cl)cc2C1.
What is the InChIKey of 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine?
The InChIKey is VQHJNKZJJQLGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3/c1-12-3-2-7-6(5-12)4-8(9)11-10-7/h4H,2-3,5H2,1H3.
What are the key properties of 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine?
3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine has a molecular weight of 183.64 g/mol, XLogP of 1.12, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-methyl-7,8-dihydro-5H-pyrido[4,3-c]pyridazine is sourced from PubChem (CID 62783672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).