1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine

C16H16N4O — CID 103374160

IUPAC1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine
SMILESCNC(c1cnc2ccccc2c1)c1ccc(OC)nn1
InChIInChI=1S/C16H16N4O/c1-17-16(14-7-8-15(21-2)20-19-14)12-9-11-5-3-4-6-13(11)18-10-12/h3-10,16-17H,1-2H3
InChIKeyHCIZNCMFCADCAC-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.34
Rot. Bonds4

About 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine

1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine (PubChem CID 103374160) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine.

Molecular Properties

Compound Name1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine
PubChem CID103374160
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine
SMILESCNC(c1cnc2ccccc2c1)c1ccc(OC)nn1
InChIInChI=1S/C16H16N4O/c1-17-16(14-7-8-15(21-2)20-19-14)12-9-11-5-3-4-6-13(11)18-10-12/h3-10,16-17H,1-2H3
InChIKeyHCIZNCMFCADCAC-UHFFFAOYSA-N
XLogP2.34
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methoxyphenyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
CID 103374118
1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
CID 103374323
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)-1-quinolin-3-ylmethanamine
CID 105097381
3-(6-methoxypyridazin-3-yl)quinoline
CID 72888998
1-(6-methoxypyridazin-3-yl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 103374212
1-(4-bromophenyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 60923508
N-methyl-1-(2-methylphenyl)-1-quinolin-3-ylmethanamine
CID 60924531
1-(2,5-dichlorophenyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 115797603
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 105097865
1-(2,5-dimethylphenyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 115798284
1-(4-ethylthiadiazol-5-yl)-N-methyl-1-quinolin-3-ylmethanamine
CID 105097449
1-(3-chloro-2-pyridinyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 103444108

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine?
The IUPAC name of 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine (CID 103374160) is 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine.
What is the SMILES notation for 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine?
The canonical SMILES for 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine is CNC(c1cnc2ccccc2c1)c1ccc(OC)nn1.
What is the InChIKey of 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine?
The InChIKey is HCIZNCMFCADCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-17-16(14-7-8-15(21-2)20-19-14)12-9-11-5-3-4-6-13(11)18-10-12/h3-10,16-17H,1-2H3.
What are the key properties of 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine?
1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine has a molecular weight of 280.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine is sourced from PubChem (CID 103374160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).