5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine

C14H10ClN3 — CID 10634780

IUPAC5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine
SMILESCc1ccc(-c2nnc(Cl)c3cccnc23)cc1
InChIInChI=1S/C14H10ClN3/c1-9-4-6-10(7-5-9)12-13-11(3-2-8-16-13)14(15)18-17-12/h2-8H,1H3
InChIKeyFQLLXVKVXDGBLU-UHFFFAOYSA-N
MW255.71 g/mol
LogP3.65
Rot. Bonds1

About 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine

5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine (PubChem CID 10634780) has the molecular formula C14H10ClN3 and a molecular weight of 255.71 g/mol. Its IUPAC name is 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine.

Molecular Properties

Compound Name5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine
PubChem CID10634780
Molecular FormulaC14H10ClN3
Molecular Weight255.71 g/mol
Exact Mass255.06
IUPAC Name5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine
SMILESCc1ccc(-c2nnc(Cl)c3cccnc23)cc1
InChIInChI=1S/C14H10ClN3/c1-9-4-6-10(7-5-9)12-13-11(3-2-8-16-13)14(15)18-17-12/h2-8H,1H3
InChIKeyFQLLXVKVXDGBLU-UHFFFAOYSA-N
XLogP3.65
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.71
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-3-(4-methylphenyl)pyridine
CID 82076857
5-(4-methylphenyl)pyrido[3,2-d]oxazin-8-one
CID 10561894
1-chloro-4-quinolin-6-ylphthalazine
CID 81230738
(8-phenylpyrido[2,3-d]pyridazin-5-yl)hydrazine
CID 10490033
4-chloro-6-methoxy-1-(4-methylphenyl)phthalazine
CID 86612224
(8-phenylpyrido[2,3-d]pyridazin-5-yl)hydrazine;dihydrochloride
CID 22449286
2-chloro-3-methyl-5,6-bis(4-methylphenyl)pyrazine
CID 59654102
2,3-dimethylpyrazino[2,3-f][4,7]phenanthroline
CID 11425448
5-(4-methylphenyl)-8-(2-phenyl-5-pyridin-2-ylphenyl)quinoline
CID 171751523
2-[3-(7-methyltriphenylen-2-yl)-5-pyridin-2-ylphenyl]pyridine
CID 145180167
2,3-bis(4-methoxyphenyl)pyrazino[2,3-f][1,10]phenanthroline
CID 21304154
bis[2-(4-methylphenyl)-3-pyridinyl]methanone
CID 67746009

Frequently Asked Questions

What is the IUPAC name of 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine?
The IUPAC name of 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine (CID 10634780) is 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine.
What is the SMILES notation for 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine?
The canonical SMILES for 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine is Cc1ccc(-c2nnc(Cl)c3cccnc23)cc1.
What is the InChIKey of 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine?
The InChIKey is FQLLXVKVXDGBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3/c1-9-4-6-10(7-5-9)12-13-11(3-2-8-16-13)14(15)18-17-12/h2-8H,1H3.
What are the key properties of 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine?
5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine has a molecular weight of 255.71 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-8-(4-methylphenyl)pyrido[2,3-d]pyridazine is sourced from PubChem (CID 10634780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).