5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one

C19H21N5O2 — CID 78116695

IUPAC5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
SMILESO=c1n(CC2CC2c2ccccn2)nc2cccc(N3CCOCC3)n12
InChIInChI=1S/C19H21N5O2/c25-19-23(13-14-12-15(14)16-4-1-2-7-20-16)21-17-5-3-6-18(24(17)19)22-8-10-26-11-9-22/h1-7,14-15H,8-13H2
InChIKeyNMRYGAKVQJYTDO-UHFFFAOYSA-N
MW351.41 g/mol
LogP1.53
Rot. Bonds4

About 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one

5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one (PubChem CID 78116695) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one.

Molecular Properties

Compound Name5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
PubChem CID78116695
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
SMILESO=c1n(CC2CC2c2ccccn2)nc2cccc(N3CCOCC3)n12
InChIInChI=1S/C19H21N5O2/c25-19-23(13-14-12-15(14)16-4-1-2-7-20-16)21-17-5-3-6-18(24(17)19)22-8-10-26-11-9-22/h1-7,14-15H,8-13H2
InChIKeyNMRYGAKVQJYTDO-UHFFFAOYSA-N
XLogP1.53
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one with MolForge

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Related Compounds

(5-morpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 83895231
5-morpholin-4-ylimidazo[1,5-a]pyridine-3-carbaldehyde
CID 83894699
2-[2-(chloromethyl)cyclopropyl]pyridine
CID 81357675
2-[2-(chloromethyl)cyclopropyl]pyridine;hydrochloride
CID 174705473
4-(2-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl)morpholine
CID 162665760
2-(3-morpholin-4-ylpropyl)-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 59225842
4-(4-pyridin-2-yl-1,3,5-triazin-2-yl)morpholine
CID 141107060
4-[2-[1-(cyclopropylmethyl)-4-(pyridin-2-ylmethyl)piperazin-2-yl]imidazo[1,2-a]pyridin-5-yl]morpholine;tetrakis(2,2,2-trifluoroacetic acid)
CID 155831488
5-morpholin-4-ylimidazo[1,5-a]pyridin-1-amine
CID 83888210
(3S,4S)-1-(2-methyl-2-morpholin-4-ylpropanoyl)-4-pyridin-2-ylpyrrolidine-3-carboxylic acid
CID 72880889
4-(4-pyridin-2-ylpyrimidin-5-yl)morpholine
CID 173446688
4-cyclohexyl-6-morpholin-4-yl-2-[[3-(trifluoromethyl)-2-pyridinyl]methyl]pyridazin-3-one
CID 177328210

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one?
The IUPAC name of 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one (CID 78116695) is 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one.
What is the SMILES notation for 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one?
The canonical SMILES for 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one is O=c1n(CC2CC2c2ccccn2)nc2cccc(N3CCOCC3)n12.
What is the InChIKey of 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one?
The InChIKey is NMRYGAKVQJYTDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c25-19-23(13-14-12-15(14)16-4-1-2-7-20-16)21-17-5-3-6-18(24(17)19)22-8-10-26-11-9-22/h1-7,14-15H,8-13H2.
What are the key properties of 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one?
5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one has a molecular weight of 351.41 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-2-[(2-pyridin-2-ylcyclopropyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one is sourced from PubChem (CID 78116695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).