2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol

C11H16N2O2 — CID 116899632

IUPAC2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol
SMILESOCCc1nccc(C2CCOCC2)n1
InChIInChI=1S/C11H16N2O2/c14-6-2-11-12-5-1-10(13-11)9-3-7-15-8-4-9/h1,5,9,14H,2-4,6-8H2
InChIKeyGBJICVCEYYUBLJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.91
Rot. Bonds3

About 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol

2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol (PubChem CID 116899632) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol
PubChem CID116899632
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol
SMILESOCCc1nccc(C2CCOCC2)n1
InChIInChI=1S/C11H16N2O2/c14-6-2-11-12-5-1-10(13-11)9-3-7-15-8-4-9/h1,5,9,14H,2-4,6-8H2
InChIKeyGBJICVCEYYUBLJ-UHFFFAOYSA-N
XLogP0.91
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-cyclohexylpyrimidin-2-yl)ethanol
CID 116899631
[4-(oxolan-3-yl)pyrimidin-2-yl]methanamine
CID 105469286
[4-(oxolan-3-yl)pyrimidin-2-yl]methanamine;hydrochloride
CID 105469285
(4-cyclopentylpyrimidin-2-yl)methanol
CID 116899510
2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol
CID 115021002
4-(4-cyclobutylpyrimidin-2-yl)butan-2-one
CID 116901689
2-amino-2-[4-(oxan-4-yl)pyrimidin-2-yl]acetic acid
CID 115041987
[1-[4-(oxan-4-yl)pyrimidin-2-yl]cyclopropyl]methanamine
CID 116902577
3-methyl-2-[4-(oxan-4-yl)pyrimidin-2-yl]butanenitrile
CID 116903397
2-[2-(oxan-4-yl)-1,3-thiazol-4-yl]ethanol
CID 115087796
3-[4-(oxan-4-yl)pyrimidin-2-yl]-8-oxa-3-azabicyclo[3.2.1]octane
CID 154628081
3-(4-cyclobutylpyrimidin-2-yl)-N-methylpropan-1-amine
CID 116898181

Frequently Asked Questions

What is the IUPAC name of 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol?
The IUPAC name of 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol (CID 116899632) is 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol.
What is the SMILES notation for 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol?
The canonical SMILES for 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol is OCCc1nccc(C2CCOCC2)n1.
What is the InChIKey of 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol?
The InChIKey is GBJICVCEYYUBLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c14-6-2-11-12-5-1-10(13-11)9-3-7-15-8-4-9/h1,5,9,14H,2-4,6-8H2.
What are the key properties of 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol?
2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol has a molecular weight of 208.26 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(oxan-4-yl)pyrimidin-2-yl]ethanol is sourced from PubChem (CID 116899632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).