3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine

C13H17N5O — CID 103374238

IUPAC3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine
SMILESCNC(Cc1cccnc1N)c1ccc(OC)nn1
InChIInChI=1S/C13H17N5O/c1-15-11(8-9-4-3-7-16-13(9)14)10-5-6-12(19-2)18-17-10/h3-7,11,15H,8H2,1-2H3,(H2,14,16)
InChIKeyCRAHUXBFQPPVSF-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.97
Rot. Bonds5

About 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine

3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine (PubChem CID 103374238) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine
PubChem CID103374238
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine
SMILESCNC(Cc1cccnc1N)c1ccc(OC)nn1
InChIInChI=1S/C13H17N5O/c1-15-11(8-9-4-3-7-16-13(9)14)10-5-6-12(19-2)18-17-10/h3-7,11,15H,8H2,1-2H3,(H2,14,16)
InChIKeyCRAHUXBFQPPVSF-UHFFFAOYSA-N
XLogP0.97
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2-(methylamino)-2-(2-methylpyrimidin-4-yl)ethyl]pyridin-2-amine
CID 113329550
3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 105190972
[1-(6-methoxypyridazin-3-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 103375674
1-(6-methoxypyridazin-3-yl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 103374344
3-[2-(methylamino)-2-(2,4,6-trifluorophenyl)ethyl]pyridin-2-amine
CID 107920651
2-(2-bromo-4-fluorophenyl)-1-(6-methoxypyridazin-3-yl)-N-methylethanamine
CID 103374283
3-[2-(methylamino)-2-(2-methylfuran-3-yl)ethyl]pyridin-2-amine
CID 113453367
3-[2-(3-bromo-4-fluorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 82809316
3-[2-(3-bromo-4-chlorophenyl)-2-(methylamino)ethyl]pyridin-2-amine
CID 115567050
N-[2-(2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethyl]propan-1-amine
CID 103374768
3-(2-methylpropyl)pyridin-2-amine
CID 20771927
3-[2-(methylamino)-2-thieno[3,2-b]pyridin-6-ylethyl]pyridin-2-amine
CID 81143119

Frequently Asked Questions

What is the IUPAC name of 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine?
The IUPAC name of 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine (CID 103374238) is 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine?
The canonical SMILES for 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine is CNC(Cc1cccnc1N)c1ccc(OC)nn1.
What is the InChIKey of 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine?
The InChIKey is CRAHUXBFQPPVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-15-11(8-9-4-3-7-16-13(9)14)10-5-6-12(19-2)18-17-10/h3-7,11,15H,8H2,1-2H3,(H2,14,16).
What are the key properties of 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine?
3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine has a molecular weight of 259.31 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(6-methoxypyridazin-3-yl)-2-(methylamino)ethyl]pyridin-2-amine is sourced from PubChem (CID 103374238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).