1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine

C14H18N4O2 — CID 103374323

IUPAC1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
SMILESCCOc1cncc(C(NC)c2ccc(OC)nn2)c1
InChIInChI=1S/C14H18N4O2/c1-4-20-11-7-10(8-16-9-11)14(15-2)12-5-6-13(19-3)18-17-12/h5-9,14-15H,4H2,1-3H3
InChIKeyIFUMQCXAEAAYOX-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.59
Rot. Bonds6

About 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine

1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine (PubChem CID 103374323) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
PubChem CID103374323
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
SMILESCCOc1cncc(C(NC)c2ccc(OC)nn2)c1
InChIInChI=1S/C14H18N4O2/c1-4-20-11-7-10(8-16-9-11)14(15-2)12-5-6-13(19-3)18-17-12/h5-9,14-15H,4H2,1-3H3
InChIKeyIFUMQCXAEAAYOX-UHFFFAOYSA-N
XLogP1.59
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(6-methoxypyridazin-3-yl)-N-methyl-1-(5-propoxy-3-pyridinyl)methanamine
CID 103374212
1-(4-methoxyphenyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine
CID 103374118
1-(6-methoxypyridazin-3-yl)-N-methyl-1-quinolin-3-ylmethanamine
CID 103374160
1-(3,5-dimethylphenyl)-1-(5-ethoxy-3-pyridinyl)-N-methylmethanamine
CID 105026319
1-(5-ethoxy-3-pyridinyl)-2,2-difluoro-N-methylethanamine
CID 103517001
1-(6-methoxypyridazin-3-yl)-N-methyl-1-(2-propoxyphenyl)methanamine
CID 103374186
[(4-chloro-2-methoxyphenyl)-(5-ethoxy-3-pyridinyl)methyl]hydrazine
CID 105330019
1-(4-bromo-3-fluorophenyl)-1-(5-ethoxy-3-pyridinyl)-N-methylmethanamine
CID 105026336
1-(3-chloro-4-iodophenyl)-1-(5-ethoxy-3-pyridinyl)-N-methylmethanamine
CID 103216066
1-(2,5-dichlorothiophen-3-yl)-1-(5-ethoxy-3-pyridinyl)-N-methylmethanamine
CID 107968897
[(5-ethoxy-3-pyridinyl)-(1,3-thiazol-4-yl)methyl]hydrazine
CID 105254414
1-(5-ethoxy-3-pyridinyl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylmethanamine
CID 103127976

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine (CID 103374323) is 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine is CCOc1cncc(C(NC)c2ccc(OC)nn2)c1.
What is the InChIKey of 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine?
The InChIKey is IFUMQCXAEAAYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-4-20-11-7-10(8-16-9-11)14(15-2)12-5-6-13(19-3)18-17-12/h5-9,14-15H,4H2,1-3H3.
What are the key properties of 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine?
1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine has a molecular weight of 274.32 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethoxy-3-pyridinyl)-1-(6-methoxypyridazin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 103374323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).