[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone

C22H19N5O2 — CID 131673609

IUPAC[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCOC(c2nnn3cc(-c4ccccc4)ccc23)C1
InChIInChI=1S/C22H19N5O2/c28-22(18-8-4-5-11-23-18)26-12-13-29-20(15-26)21-19-10-9-17(14-27(19)25-24-21)16-6-2-1-3-7-16/h1-11,14,20H,12-13,15H2
InChIKeyMIJIPDPRWZNDJU-UHFFFAOYSA-N
MW385.43 g/mol
LogP3.01
Rot. Bonds3

About [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone

[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone (PubChem CID 131673609) has the molecular formula C22H19N5O2 and a molecular weight of 385.43 g/mol. Its IUPAC name is [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone
PubChem CID131673609
Molecular FormulaC22H19N5O2
Molecular Weight385.43 g/mol
Exact Mass385.15
IUPAC Name[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCOC(c2nnn3cc(-c4ccccc4)ccc23)C1
InChIInChI=1S/C22H19N5O2/c28-22(18-8-4-5-11-23-18)26-12-13-29-20(15-26)21-19-10-9-17(14-27(19)25-24-21)16-6-2-1-3-7-16/h1-11,14,20H,12-13,15H2
InChIKeyMIJIPDPRWZNDJU-UHFFFAOYSA-N
XLogP3.01
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.43
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)-4-(pyridin-2-ylmethyl)morpholine;bis(2,2,2-trifluoroacetic acid)
CID 155834497
(4-methylphenyl)-[2-(6-pyridin-4-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone;2,2,2-trifluoroacetic acid
CID 155852687
[2-[6-(4-methoxyphenyl)triazolo[1,5-a]pyridin-3-yl]morpholin-4-yl]-thiophen-3-ylmethanone
CID 131670981
[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]-pyridin-2-ylmethanone
CID 125024334
4-(furan-3-ylmethyl)-2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholine;2,2,2-trifluoroacetic acid
CID 155831144
1,2-oxazol-5-yl-[2-(6-pyrrolidin-1-yltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]methanone
CID 131671010
[3-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-pyridin-2-ylmethanone
CID 75615733
4-(pyridin-3-ylmethyl)-2-(6-pyridin-3-yltriazolo[1,5-a]pyridin-3-yl)morpholine;tris(2,2,2-trifluoroacetic acid)
CID 155825843
[2-(1-but-3-enyltriazol-4-yl)morpholin-4-yl]-(5-phenyl-2-pyridinyl)methanone
CID 167923159
[(2S)-2-(4-tert-butyl-1,3-thiazol-2-yl)morpholin-4-yl]-pyridin-2-ylmethanone
CID 100746996
pyridin-4-yl-[3-(6-pyridin-4-yltriazolo[1,5-a]pyridin-3-yl)pyrrolidin-1-yl]methanone;bis(2,2,2-trifluoroacetic acid)
CID 155866696
2-[6-(4-methylphenyl)triazolo[1,5-a]pyridin-3-yl]-4-(1,3-thiazol-2-ylmethyl)morpholine;2,2,2-trifluoroacetic acid
CID 155825790

Frequently Asked Questions

What is the IUPAC name of [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone?
The IUPAC name of [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone (CID 131673609) is [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone is O=C(c1ccccn1)N1CCOC(c2nnn3cc(-c4ccccc4)ccc23)C1.
What is the InChIKey of [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone?
The InChIKey is MIJIPDPRWZNDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O2/c28-22(18-8-4-5-11-23-18)26-12-13-29-20(15-26)21-19-10-9-17(14-27(19)25-24-21)16-6-2-1-3-7-16/h1-11,14,20H,12-13,15H2.
What are the key properties of [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone?
[2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone has a molecular weight of 385.43 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-phenyltriazolo[1,5-a]pyridin-3-yl)morpholin-4-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 131673609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).