2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol

C24H36N4O4 — CID 157434394

IUPAC2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol
SMILESCc1nc(N2CCOCC2)c(C)c(C)c1O.Cc1nc(N2CCOCC2)c(C)c(C)c1O
InChIInChI=1S/2C12H18N2O2/c2*1-8-9(2)12(13-10(3)11(8)15)14-4-6-16-7-5-14/h2*15H,4-7H2,1-3H3
InChIKeyBQXQTSZIDRFCAQ-UHFFFAOYSA-N
MW444.58 g/mol
LogP3.10
Rot. Bonds2

About 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol

2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol (PubChem CID 157434394) has the molecular formula C24H36N4O4 and a molecular weight of 444.58 g/mol. Its IUPAC name is 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol.

Molecular Properties

Compound Name2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol
PubChem CID157434394
Molecular FormulaC24H36N4O4
Molecular Weight444.58 g/mol
Exact Mass444.27
IUPAC Name2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol
SMILESCc1nc(N2CCOCC2)c(C)c(C)c1O.Cc1nc(N2CCOCC2)c(C)c(C)c1O
InChIInChI=1S/2C12H18N2O2/c2*1-8-9(2)12(13-10(3)11(8)15)14-4-6-16-7-5-14/h2*15H,4-7H2,1-3H3
InChIKeyBQXQTSZIDRFCAQ-UHFFFAOYSA-N
XLogP3.10
TPSA91.18 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.58
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol?
The IUPAC name of 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol (CID 157434394) is 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol.
What is the SMILES notation for 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol?
The canonical SMILES for 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol is Cc1nc(N2CCOCC2)c(C)c(C)c1O.Cc1nc(N2CCOCC2)c(C)c(C)c1O.
What is the InChIKey of 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol?
The InChIKey is BQXQTSZIDRFCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H18N2O2/c2*1-8-9(2)12(13-10(3)11(8)15)14-4-6-16-7-5-14/h2*15H,4-7H2,1-3H3.
What are the key properties of 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol?
2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol has a molecular weight of 444.58 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-6-morpholin-4-ylpyridin-3-ol is sourced from PubChem (CID 157434394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).