3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione

C17H27N3O4 — CID 91574985

IUPAC3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione
SMILESO=c1cc(O)n(CCCN2CCOCC2)c(=O)n1C1CCCCC1
InChIInChI=1S/C17H27N3O4/c21-15-13-16(22)20(14-5-2-1-3-6-14)17(23)19(15)8-4-7-18-9-11-24-12-10-18/h13-14,21H,1-12H2
InChIKeyFAAOMFWTXLEHGA-UHFFFAOYSA-N
MW337.42 g/mol
LogP0.94
Rot. Bonds5

About 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione

3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione (PubChem CID 91574985) has the molecular formula C17H27N3O4 and a molecular weight of 337.42 g/mol. Its IUPAC name is 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione.

Molecular Properties

Compound Name3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione
PubChem CID91574985
Molecular FormulaC17H27N3O4
Molecular Weight337.42 g/mol
Exact Mass337.20
IUPAC Name3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione
SMILESO=c1cc(O)n(CCCN2CCOCC2)c(=O)n1C1CCCCC1
InChIInChI=1S/C17H27N3O4/c21-15-13-16(22)20(14-5-2-1-3-6-14)17(23)19(15)8-4-7-18-9-11-24-12-10-18/h13-14,21H,1-12H2
InChIKeyFAAOMFWTXLEHGA-UHFFFAOYSA-N
XLogP0.94
TPSA76.70 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione?
The IUPAC name of 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione (CID 91574985) is 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione.
What is the SMILES notation for 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione?
The canonical SMILES for 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione is O=c1cc(O)n(CCCN2CCOCC2)c(=O)n1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione?
The InChIKey is FAAOMFWTXLEHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O4/c21-15-13-16(22)20(14-5-2-1-3-6-14)17(23)19(15)8-4-7-18-9-11-24-12-10-18/h13-14,21H,1-12H2.
What are the key properties of 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione?
3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione has a molecular weight of 337.42 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione is sourced from PubChem (CID 91574985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).