2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine

C16H19N5O — CID 163319520

IUPAC2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine
SMILESCOCC(c1ccccn1)N(C)Cc1ccn2ncnc2c1
InChIInChI=1S/C16H19N5O/c1-20(15(11-22-2)14-5-3-4-7-17-14)10-13-6-8-21-16(9-13)18-12-19-21/h3-9,12,15H,10-11H2,1-2H3
InChIKeyFUMZLLFYCQJYMF-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.94
Rot. Bonds6

About 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine

2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine (PubChem CID 163319520) has the molecular formula C16H19N5O and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine
PubChem CID163319520
Molecular FormulaC16H19N5O
Molecular Weight297.36 g/mol
Exact Mass297.16
IUPAC Name2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine
SMILESCOCC(c1ccccn1)N(C)Cc1ccn2ncnc2c1
InChIInChI=1S/C16H19N5O/c1-20(15(11-22-2)14-5-3-4-7-17-14)10-13-6-8-21-16(9-13)18-12-19-21/h3-9,12,15H,10-11H2,1-2H3
InChIKeyFUMZLLFYCQJYMF-UHFFFAOYSA-N
XLogP1.94
TPSA55.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine?
The IUPAC name of 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine (CID 163319520) is 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine.
What is the SMILES notation for 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine?
The canonical SMILES for 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine is COCC(c1ccccn1)N(C)Cc1ccn2ncnc2c1.
What is the InChIKey of 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine?
The InChIKey is FUMZLLFYCQJYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O/c1-20(15(11-22-2)14-5-3-4-7-17-14)10-13-6-8-21-16(9-13)18-12-19-21/h3-9,12,15H,10-11H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine?
2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine has a molecular weight of 297.36 g/mol, XLogP of 1.94, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-pyridin-2-yl-N-([1,2,4]triazolo[1,5-a]pyridin-7-ylmethyl)ethanamine is sourced from PubChem (CID 163319520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).