2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one

C12H16N4O2 — CID 117135614

IUPAC2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
SMILESO=c1ccn2[nH]c(CCN3CCOCC3)nc2c1
InChIInChI=1S/C12H16N4O2/c17-10-1-4-16-12(9-10)13-11(14-16)2-3-15-5-7-18-8-6-15/h1,4,9H,2-3,5-8H2,(H,13,14)
InChIKeyQOAGORXIMRAMEL-UHFFFAOYSA-N
MW248.29 g/mol
LogP-0.10
Rot. Bonds3

About 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one

2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one (PubChem CID 117135614) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
PubChem CID117135614
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC Name2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one
SMILESO=c1ccn2[nH]c(CCN3CCOCC3)nc2c1
InChIInChI=1S/C12H16N4O2/c17-10-1-4-16-12(9-10)13-11(14-16)2-3-15-5-7-18-8-6-15/h1,4,9H,2-3,5-8H2,(H,13,14)
InChIKeyQOAGORXIMRAMEL-UHFFFAOYSA-N
XLogP-0.10
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(4-fluorophenyl)ethyl]morpholine
CID 100965302
4-[3-(1H-indazol-5-yl)propyl]morpholine
CID 170870011
2-(2-morpholin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbaldehyde
CID 117135596
5-(2-morpholin-4-ylethyl)-1,3-dihydroindol-2-one
CID 10198779
4-[2-(2H-triazol-4-yl)ethyl]morpholine
CID 54167756
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
2-(2-morpholin-4-ylethyl)-1H-pyrrol-3-amine
CID 82400247
4-(3-quinoxalin-6-ylpropyl)morpholine
CID 170869858
methane;4-(2-phenylethyl)morpholine
CID 143698819
4-[3-(4-iodophenyl)propyl]morpholine
CID 143873101
4-[2-(1,2-oxazol-5-yl)ethyl]morpholine
CID 173251895
4-[3-(3H-benzimidazol-5-yl)propyl]morpholine
CID 170870089

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The IUPAC name of 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one (CID 117135614) is 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one.
What is the SMILES notation for 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The canonical SMILES for 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one is O=c1ccn2[nH]c(CCN3CCOCC3)nc2c1.
What is the InChIKey of 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
The InChIKey is QOAGORXIMRAMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c17-10-1-4-16-12(9-10)13-11(14-16)2-3-15-5-7-18-8-6-15/h1,4,9H,2-3,5-8H2,(H,13,14).
What are the key properties of 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one?
2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one has a molecular weight of 248.29 g/mol, XLogP of -0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-7-one is sourced from PubChem (CID 117135614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).