N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide

C15H15N5O2 — CID 86979795

IUPACN-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCN(Cc1cccnc1)C(=O)Cn1nc2ccccn2c1=O
InChIInChI=1S/C15H15N5O2/c1-18(10-12-5-4-7-16-9-12)14(21)11-20-15(22)19-8-3-2-6-13(19)17-20/h2-9H,10-11H2,1H3
InChIKeyURABEZFJGXUAHN-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.55
Rot. Bonds4

About N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide

N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 86979795) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID86979795
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC NameN-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCN(Cc1cccnc1)C(=O)Cn1nc2ccccn2c1=O
InChIInChI=1S/C15H15N5O2/c1-18(10-12-5-4-7-16-9-12)14(21)11-20-15(22)19-8-3-2-6-13(19)17-20/h2-9H,10-11H2,1H3
InChIKeyURABEZFJGXUAHN-UHFFFAOYSA-N
XLogP0.55
TPSA72.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide with MolForge

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Related Compounds

2-[methyl-[2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetyl]amino]acetic acid
CID 43132370
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetamide
CID 63940029
N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-phenylacetamide
CID 134007051
N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetamide
CID 47074456
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 110724689
N-benzyl-N-methyl-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)acetamide
CID 121052466
2-chloro-N-methyl-N-(pyridin-3-ylmethyl)acetamide
CID 19420340
methyl 3-[methyl(pyridin-3-ylmethyl)amino]-3-oxopropanoate
CID 115174424
N-methyl-2-(methylamino)-N-(pyridin-3-ylmethyl)acetamide
CID 43563676
N-cyclopropyl-N-[(3,4-dimethylphenyl)methyl]-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetamide
CID 99816905
2-[cyclopropyl-[2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetyl]amino]propanoic acid
CID 119202580
N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide
CID 110724694

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide (CID 86979795) is N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide is CN(Cc1cccnc1)C(=O)Cn1nc2ccccn2c1=O.
What is the InChIKey of N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is URABEZFJGXUAHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-18(10-12-5-4-7-16-9-12)14(21)11-20-15(22)19-8-3-2-6-13(19)17-20/h2-9H,10-11H2,1H3.
What are the key properties of N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide?
N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 297.32 g/mol, XLogP of 0.55, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 86979795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).