4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide

C19H21N5O3 — CID 172671508

IUPAC4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccn(CC2CCCO2)c(=O)c1C(=O)NCc1cccc2ncnn12
InChIInChI=1S/C19H21N5O3/c1-13-7-8-23(11-15-5-3-9-27-15)19(26)17(13)18(25)20-10-14-4-2-6-16-21-12-22-24(14)16/h2,4,6-8,12,15H,3,5,9-11H2,1H3,(H,20,25)
InChIKeyHOQAULQGXYZSGJ-UHFFFAOYSA-N
MW367.41 g/mol
LogP1.31
Rot. Bonds5

About 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide

4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide (PubChem CID 172671508) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide
PubChem CID172671508
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccn(CC2CCCO2)c(=O)c1C(=O)NCc1cccc2ncnn12
InChIInChI=1S/C19H21N5O3/c1-13-7-8-23(11-15-5-3-9-27-15)19(26)17(13)18(25)20-10-14-4-2-6-16-21-12-22-24(14)16/h2,4,6-8,12,15H,3,5,9-11H2,1H3,(H,20,25)
InChIKeyHOQAULQGXYZSGJ-UHFFFAOYSA-N
XLogP1.31
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide (CID 172671508) is 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide is Cc1ccn(CC2CCCO2)c(=O)c1C(=O)NCc1cccc2ncnn12.
What is the InChIKey of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide?
The InChIKey is HOQAULQGXYZSGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-13-7-8-23(11-15-5-3-9-27-15)19(26)17(13)18(25)20-10-14-4-2-6-16-21-12-22-24(14)16/h2,4,6-8,12,15H,3,5,9-11H2,1H3,(H,20,25).
What are the key properties of 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide?
4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-oxo-1-(oxolan-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyridin-5-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 172671508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).