[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol

C11H18N4O3 — CID 114053206

IUPAC[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
SMILESCOc1cc(N2CC(CO)OCC2C)nc(N)n1
InChIInChI=1S/C11H18N4O3/c1-7-6-18-8(5-16)4-15(7)9-3-10(17-2)14-11(12)13-9/h3,7-8,16H,4-6H2,1-2H3,(H2,12,13,14)
InChIKeyQEHCGNDNUPEYIT-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.35
Rot. Bonds3

About [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol

[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol (PubChem CID 114053206) has the molecular formula C11H18N4O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
PubChem CID114053206
Molecular FormulaC11H18N4O3
Molecular Weight254.29 g/mol
Exact Mass254.14
IUPAC Name[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol
SMILESCOc1cc(N2CC(CO)OCC2C)nc(N)n1
InChIInChI=1S/C11H18N4O3/c1-7-6-18-8(5-16)4-15(7)9-3-10(17-2)14-11(12)13-9/h3,7-8,16H,4-6H2,1-2H3,(H2,12,13,14)
InChIKeyQEHCGNDNUPEYIT-UHFFFAOYSA-N
XLogP-0.35
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol 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-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol (CID 114053206) is [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol is COc1cc(N2CC(CO)OCC2C)nc(N)n1.
What is the InChIKey of [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol?
The InChIKey is QEHCGNDNUPEYIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3/c1-7-6-18-8(5-16)4-15(7)9-3-10(17-2)14-11(12)13-9/h3,7-8,16H,4-6H2,1-2H3,(H2,12,13,14).
What are the key properties of [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol?
[4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol has a molecular weight of 254.29 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-amino-6-methoxypyrimidin-4-yl)-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 114053206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).