1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone

C18H20N6O3 — CID 131671010

IUPAC1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone
SMILESO=C(c1ccno1)N1CCOC(c2nnn3cc(N4CCCC4)ccc23)C1
InChIInChI=1S/C18H20N6O3/c25-18(15-5-6-19-27-15)23-9-10-26-16(12-23)17-14-4-3-13(11-24(14)21-20-17)22-7-1-2-8-22/h3-6,11,16H,1-2,7-10,12H2
InChIKeyLPBWRBVHAQKYAI-UHFFFAOYSA-N
MW368.40 g/mol
LogP1.53
Rot. Bonds3

About 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone

1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone (PubChem CID 131671010) has the molecular formula C18H20N6O3 and a molecular weight of 368.40 g/mol. Its IUPAC name is 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone
PubChem CID131671010
Molecular FormulaC18H20N6O3
Molecular Weight368.40 g/mol
Exact Mass368.16
IUPAC Name1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone
SMILESO=C(c1ccno1)N1CCOC(c2nnn3cc(N4CCCC4)ccc23)C1
InChIInChI=1S/C18H20N6O3/c25-18(15-5-6-19-27-15)23-9-10-26-16(12-23)17-14-4-3-13(11-24(14)21-20-17)22-7-1-2-8-22/h3-6,11,16H,1-2,7-10,12H2
InChIKeyLPBWRBVHAQKYAI-UHFFFAOYSA-N
XLogP1.53
TPSA89.00 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.40
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone
CID 131673609
(4-methylphenyl)-[2-(6-pyridin-4-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone;2,2,2-trifluoroacetic acid
CID 155852687
[(2R)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]-(4-pyrrolidin-1-ylphenyl)methanone
CID 125009661
[2-[6-(4-methoxyphenyl)triazolo[1,5-a]pyridin-3-yl]morpholin-4-yl]-thiophen-3-ylmethanone
CID 131670981
1,2-oxazol-5-yl-[(3R)-3-phenylpyrrolidin-1-yl]methanone
CID 51897824
[4-(4-methoxyphenyl)piperazin-1-yl]-(1,2-oxazol-5-yl)methanone
CID 110693625
[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(4-pyrrolidin-1-ylphenyl)methanone
CID 125010402
[(5aR,9aS)-4-methyl-2,3,5,5a,6,7,9,9a-octahydropyrido[4,3-f][1,4]oxazepin-8-yl]-(1,2-oxazol-5-yl)methanone
CID 97403369
cyclopropyl-[2-(6-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)morpholin-4-yl]methanone;2,2,2-trifluoroacetic acid
CID 155861466
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-(1,2-oxazol-5-yl)methanone
CID 115825892
[(5aS,9aR)-4-(6-methylpyridazin-3-yl)-2,3,5,5a,6,7,9,9a-octahydropyrido[4,3-f][1,4]oxazepin-8-yl]-(1,2-oxazol-5-yl)methanone
CID 124797487
4-(pyridin-3-ylmethyl)-2-(6-pyridin-3-yltriazolo[1,5-a]pyridin-3-yl)morpholine;tris(2,2,2-trifluoroacetic acid)
CID 155825843

Frequently Asked Questions

What is the IUPAC name of 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone?
The IUPAC name of 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone (CID 131671010) is 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone.
What is the SMILES notation for 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone?
The canonical SMILES for 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone is O=C(c1ccno1)N1CCOC(c2nnn3cc(N4CCCC4)ccc23)C1.
What is the InChIKey of 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone?
The InChIKey is LPBWRBVHAQKYAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O3/c25-18(15-5-6-19-27-15)23-9-10-26-16(12-23)17-14-4-3-13(11-24(14)21-20-17)22-7-1-2-8-22/h3-6,11,16H,1-2,7-10,12H2.
What are the key properties of 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone?
1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone has a molecular weight of 368.40 g/mol, XLogP of 1.53, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 131671010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).