methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate

C20H23N5O3 — CID 82565513

IUPACmethyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
SMILESCOC(=O)c1c(-c2cccnc2)cc(C)n2nc(CCN3CCOCC3)nc12
InChIInChI=1S/C20H23N5O3/c1-14-12-16(15-4-3-6-21-13-15)18(20(26)27-2)19-22-17(23-25(14)19)5-7-24-8-10-28-11-9-24/h3-4,6,12-13H,5,7-11H2,1-2H3
InChIKeyYVAYIXLRYOCDJU-UHFFFAOYSA-N
MW381.44 g/mol
LogP1.76
Rot. Bonds5

About methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate

methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate (PubChem CID 82565513) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate.

Molecular Properties

Compound Namemethyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
PubChem CID82565513
Molecular FormulaC20H23N5O3
Molecular Weight381.44 g/mol
Exact Mass381.18
IUPAC Namemethyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
SMILESCOC(=O)c1c(-c2cccnc2)cc(C)n2nc(CCN3CCOCC3)nc12
InChIInChI=1S/C20H23N5O3/c1-14-12-16(15-4-3-6-21-13-15)18(20(26)27-2)19-22-17(23-25(14)19)5-7-24-8-10-28-11-9-24/h3-4,6,12-13H,5,7-11H2,1-2H3
InChIKeyYVAYIXLRYOCDJU-UHFFFAOYSA-N
XLogP1.76
TPSA81.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate with MolForge

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Launch Full Analysis

Related Compounds

2-(2-methoxyethyl)-5-methyl-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 82565356
5-ethyl-2-methyl-1-(3-morpholin-4-ylpropyl)-4-pyridin-3-ylpyrrole-3-carboxamide
CID 3836326
2-methyl-N-(3-morpholin-4-ylpropyl)-6-pyridin-3-ylpyrimidin-4-amine
CID 4998539
methyl (4S)-2-amino-7-methyl-6-(2-morpholin-4-ylethyl)-5-oxo-4-pyridin-3-yl-4H-pyrano[3,2-c]pyridine-3-carboxylate
CID 2034759
2-imino-N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridine-1-carboxamide
CID 144979622
methyl 2,3,5,6-tetrafluoro-4-pyridin-3-ylbenzoate
CID 46317647
6-methyl-N-(3-morpholin-4-ylpropyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 50798366
2-morpholin-4-ylethyl pyridine-3-carboxylate;hydrochloride
CID 50944397
methyl 3-[[1-(2-morpholin-4-ylethyl)-4-phenylpyrazol-5-yl]amino]pyridine-4-carboxylate
CID 118969838
ethyl 4-methyl-6-morpholin-4-yl-2-pyridin-3-ylpyrimidine-5-carboxylate
CID 139881750
methyl 2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 117257645
4-[2-[[4-(4-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethyl]morpholine
CID 1151001

Frequently Asked Questions

What is the IUPAC name of methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate?
The IUPAC name of methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate (CID 82565513) is methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate.
What is the SMILES notation for methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate?
The canonical SMILES for methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate is COC(=O)c1c(-c2cccnc2)cc(C)n2nc(CCN3CCOCC3)nc12.
What is the InChIKey of methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate?
The InChIKey is YVAYIXLRYOCDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-14-12-16(15-4-3-6-21-13-15)18(20(26)27-2)19-22-17(23-25(14)19)5-7-24-8-10-28-11-9-24/h3-4,6,12-13H,5,7-11H2,1-2H3.
What are the key properties of methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate?
methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate has a molecular weight of 381.44 g/mol, XLogP of 1.76, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-methyl-2-(2-morpholin-4-ylethyl)-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate is sourced from PubChem (CID 82565513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).