2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol

C11H17N3O2 — CID 75444426

IUPAC2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol
SMILESCc1ccnc(N2CCOCC2CCO)n1
InChIInChI=1S/C11H17N3O2/c1-9-2-4-12-11(13-9)14-5-7-16-8-10(14)3-6-15/h2,4,10,15H,3,5-8H2,1H3
InChIKeyBWKYGPWGIHNKCE-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.37
Rot. Bonds3

About 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol

2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol (PubChem CID 75444426) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol.

Molecular Properties

Compound Name2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol
PubChem CID75444426
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol
SMILESCc1ccnc(N2CCOCC2CCO)n1
InChIInChI=1S/C11H17N3O2/c1-9-2-4-12-11(13-9)14-5-7-16-8-10(14)3-6-15/h2,4,10,15H,3,5-8H2,1H3
InChIKeyBWKYGPWGIHNKCE-UHFFFAOYSA-N
XLogP0.37
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol?
The IUPAC name of 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol (CID 75444426) is 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol.
What is the SMILES notation for 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol?
The canonical SMILES for 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol is Cc1ccnc(N2CCOCC2CCO)n1.
What is the InChIKey of 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol?
The InChIKey is BWKYGPWGIHNKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-9-2-4-12-11(13-9)14-5-7-16-8-10(14)3-6-15/h2,4,10,15H,3,5-8H2,1H3.
What are the key properties of 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol?
2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol has a molecular weight of 223.28 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylpyrimidin-2-yl)morpholin-3-yl]ethanol is sourced from PubChem (CID 75444426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).