(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

C16H17N3O2 — CID 56724388

IUPAC(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1ccc(C(=O)N2CCCc3cc(C)ccc32)nn1
InChIInChI=1S/C16H17N3O2/c1-11-5-7-14-12(10-11)4-3-9-19(14)16(20)13-6-8-15(21-2)18-17-13/h5-8,10H,3-4,9H2,1-2H3
InChIKeyFQKGYOBCCWJTIN-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.39
Rot. Bonds2

About (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (PubChem CID 56724388) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.

Molecular Properties

Compound Name(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
PubChem CID56724388
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCOc1ccc(C(=O)N2CCCc3cc(C)ccc32)nn1
InChIInChI=1S/C16H17N3O2/c1-11-5-7-14-12(10-11)4-3-9-19(14)16(20)13-6-8-15(21-2)18-17-13/h5-8,10H,3-4,9H2,1-2H3
InChIKeyFQKGYOBCCWJTIN-UHFFFAOYSA-N
XLogP2.39
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The IUPAC name of (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (CID 56724388) is (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.
What is the SMILES notation for (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The canonical SMILES for (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is COc1ccc(C(=O)N2CCCc3cc(C)ccc32)nn1.
What is the InChIKey of (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The InChIKey is FQKGYOBCCWJTIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-11-5-7-14-12(10-11)4-3-9-19(14)16(20)13-6-8-15(21-2)18-17-13/h5-8,10H,3-4,9H2,1-2H3.
What are the key properties of (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
(6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone has a molecular weight of 283.33 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxypyridazin-3-yl)-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is sourced from PubChem (CID 56724388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).