1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one

C18H28N2O3 — CID 94960120

IUPAC1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESO=c1cc(CN2CCOCC2)n(C2CCCCCCC2)cc1O
InChIInChI=1S/C18H28N2O3/c21-17-12-16(13-19-8-10-23-11-9-19)20(14-18(17)22)15-6-4-2-1-3-5-7-15/h12,14-15,22H,1-11,13H2
InChIKeyATQQQWDMBQCUCI-UHFFFAOYSA-N
MW320.43 g/mol
LogP2.67
Rot. Bonds3

About 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one

1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one (PubChem CID 94960120) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one.

Molecular Properties

Compound Name1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
PubChem CID94960120
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
SMILESO=c1cc(CN2CCOCC2)n(C2CCCCCCC2)cc1O
InChIInChI=1S/C18H28N2O3/c21-17-12-16(13-19-8-10-23-11-9-19)20(14-18(17)22)15-6-4-2-1-3-5-7-15/h12,14-15,22H,1-11,13H2
InChIKeyATQQQWDMBQCUCI-UHFFFAOYSA-N
XLogP2.67
TPSA54.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclooctyl-5-hydroxy-2-(piperidin-1-ylmethyl)pyridin-4-one
CID 94960122
1-cyclopentyl-2-[(4-ethylpiperazin-1-yl)methyl]-5-hydroxypyridin-4-one
CID 82218423
1-cyclohexyl-5-hydroxy-2-[(2-methylpiperidin-1-yl)methyl]pyridin-4-one
CID 82218445
5-hydroxy-2-(morpholin-4-ylmethyl)-1-prop-2-enylpyridin-4-one
CID 82218404
5-hydroxy-1-(2-hydroxypropyl)-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 82218215
1-(3-ethoxypropyl)-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 82218677
1-[2-(cyclohexen-1-yl)ethyl]-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94961024
1-[4-(dimethylamino)butyl]-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one
CID 94960996
2-[[butyl(ethyl)amino]methyl]-1-cycloheptyl-5-hydroxypyridin-4-one
CID 94960137
2-[[butyl(methyl)amino]methyl]-1-cyclopentyl-5-hydroxypyridin-4-one
CID 82218438
2-[[bis(2-methoxyethyl)amino]methyl]-1-cyclopentyl-5-hydroxypyridin-4-one
CID 82218421
5-hydroxy-1-(oxolan-2-ylmethyl)-2-(pyrrolidin-1-ylmethyl)pyridin-4-one
CID 82218489

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one?
The IUPAC name of 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one (CID 94960120) is 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one.
What is the SMILES notation for 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one?
The canonical SMILES for 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one is O=c1cc(CN2CCOCC2)n(C2CCCCCCC2)cc1O.
What is the InChIKey of 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one?
The InChIKey is ATQQQWDMBQCUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c21-17-12-16(13-19-8-10-23-11-9-19)20(14-18(17)22)15-6-4-2-1-3-5-7-15/h12,14-15,22H,1-11,13H2.
What are the key properties of 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one?
1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one has a molecular weight of 320.43 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-5-hydroxy-2-(morpholin-4-ylmethyl)pyridin-4-one is sourced from PubChem (CID 94960120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).