1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one

C14H22N2O2 — CID 126731272

IUPAC1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one
SMILESCc1c(C)n(C)cc(C(C)N2CCOCC2)c1=O
InChIInChI=1S/C14H22N2O2/c1-10-11(2)15(4)9-13(14(10)17)12(3)16-5-7-18-8-6-16/h9,12H,5-8H2,1-4H3
InChIKeyULSNIMFOPZGSST-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.40
Rot. Bonds2

About 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one

1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one (PubChem CID 126731272) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one.

Molecular Properties

Compound Name1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one
PubChem CID126731272
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one
SMILESCc1c(C)n(C)cc(C(C)N2CCOCC2)c1=O
InChIInChI=1S/C14H22N2O2/c1-10-11(2)15(4)9-13(14(10)17)12(3)16-5-7-18-8-6-16/h9,12H,5-8H2,1-4H3
InChIKeyULSNIMFOPZGSST-UHFFFAOYSA-N
XLogP1.40
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one?
The IUPAC name of 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one (CID 126731272) is 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one.
What is the SMILES notation for 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one?
The canonical SMILES for 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one is Cc1c(C)n(C)cc(C(C)N2CCOCC2)c1=O.
What is the InChIKey of 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one?
The InChIKey is ULSNIMFOPZGSST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-11(2)15(4)9-13(14(10)17)12(3)16-5-7-18-8-6-16/h9,12H,5-8H2,1-4H3.
What are the key properties of 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one?
1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one has a molecular weight of 250.34 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trimethyl-5-(1-morpholin-4-ylethyl)pyridin-4-one is sourced from PubChem (CID 126731272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).