2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone

C18H25N5O3 — CID 97362333

IUPAC2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone
SMILESCOCC(=O)N1CCC(c2nc3ccc(N4CCOCC4)cn3n2)CC1
InChIInChI=1S/C18H25N5O3/c1-25-13-17(24)22-6-4-14(5-7-22)18-19-16-3-2-15(12-23(16)20-18)21-8-10-26-11-9-21/h2-3,12,14H,4-11,13H2,1H3
InChIKeyHXVNOSZLAIEACC-UHFFFAOYSA-N
MW359.43 g/mol
LogP0.92
Rot. Bonds4

About 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone

2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone (PubChem CID 97362333) has the molecular formula C18H25N5O3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone
PubChem CID97362333
Molecular FormulaC18H25N5O3
Molecular Weight359.43 g/mol
Exact Mass359.20
IUPAC Name2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone
SMILESCOCC(=O)N1CCC(c2nc3ccc(N4CCOCC4)cn3n2)CC1
InChIInChI=1S/C18H25N5O3/c1-25-13-17(24)22-6-4-14(5-7-22)18-19-16-3-2-15(12-23(16)20-18)21-8-10-26-11-9-21/h2-3,12,14H,4-11,13H2,1H3
InChIKeyHXVNOSZLAIEACC-UHFFFAOYSA-N
XLogP0.92
TPSA72.20 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone?
The IUPAC name of 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone (CID 97362333) is 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone.
What is the SMILES notation for 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone?
The canonical SMILES for 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone is COCC(=O)N1CCC(c2nc3ccc(N4CCOCC4)cn3n2)CC1.
What is the InChIKey of 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone?
The InChIKey is HXVNOSZLAIEACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O3/c1-25-13-17(24)22-6-4-14(5-7-22)18-19-16-3-2-15(12-23(16)20-18)21-8-10-26-11-9-21/h2-3,12,14H,4-11,13H2,1H3.
What are the key properties of 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone?
2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone has a molecular weight of 359.43 g/mol, XLogP of 0.92, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-[4-(6-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-1-yl]ethanone is sourced from PubChem (CID 97362333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).