4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one

C11H17N3O4 — CID 168923664

IUPAC4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCC(O)Cc1c(O)nc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C11H17N3O4/c1-7(15)6-8-9(16)12-11(13-10(8)17)14-2-4-18-5-3-14/h7,15H,2-6H2,1H3,(H2,12,13,16,17)
InChIKeyMKNOUVWXRQGZCT-UHFFFAOYSA-N
MW255.27 g/mol
LogP-0.76
Rot. Bonds3

About 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one

4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one (PubChem CID 168923664) has the molecular formula C11H17N3O4 and a molecular weight of 255.27 g/mol. Its IUPAC name is 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
PubChem CID168923664
Molecular FormulaC11H17N3O4
Molecular Weight255.27 g/mol
Exact Mass255.12
IUPAC Name4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCC(O)Cc1c(O)nc(N2CCOCC2)[nH]c1=O
InChIInChI=1S/C11H17N3O4/c1-7(15)6-8-9(16)12-11(13-10(8)17)14-2-4-18-5-3-14/h7,15H,2-6H2,1H3,(H2,12,13,16,17)
InChIKeyMKNOUVWXRQGZCT-UHFFFAOYSA-N
XLogP-0.76
TPSA98.68 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one 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 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one (CID 168923664) is 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one is CC(O)Cc1c(O)nc(N2CCOCC2)[nH]c1=O.
What is the InChIKey of 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The InChIKey is MKNOUVWXRQGZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4/c1-7(15)6-8-9(16)12-11(13-10(8)17)14-2-4-18-5-3-14/h7,15H,2-6H2,1H3,(H2,12,13,16,17).
What are the key properties of 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one has a molecular weight of 255.27 g/mol, XLogP of -0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-(2-hydroxypropyl)-2-morpholin-4-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 168923664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).