(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol

C12H20N2O2 — CID 103431278

IUPAC(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol
SMILESCCOC(C)(C)c1ncc([C@@H](C)O)c(C)n1
InChIInChI=1S/C12H20N2O2/c1-6-16-12(4,5)11-13-7-10(9(3)15)8(2)14-11/h7,9,15H,6H2,1-5H3/t9-/m1/s1
InChIKeyWWCVHDJZULMHKT-SECBINFHSA-N
MW224.30 g/mol
LogP2.11
Rot. Bonds4

About (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol

(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol (PubChem CID 103431278) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol
PubChem CID103431278
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol
SMILESCCOC(C)(C)c1ncc([C@@H](C)O)c(C)n1
InChIInChI=1S/C12H20N2O2/c1-6-16-12(4,5)11-13-7-10(9(3)15)8(2)14-11/h7,9,15H,6H2,1-5H3/t9-/m1/s1
InChIKeyWWCVHDJZULMHKT-SECBINFHSA-N
XLogP2.11
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-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

1-[2-(2-ethoxybutan-2-yl)-4-methylpyrimidin-5-yl]ethanol
CID 116779034
1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 116731311
N-[[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]methyl]propan-2-amine
CID 114206482
(1S)-1-[4-methyl-2-(2-phenylpropan-2-yl)pyrimidin-5-yl]ethanol
CID 103431527
1-[2-(2-ethoxybutan-2-yl)-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 116778892
(1S)-1-[2-(2-ethoxybutan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 103431973
5-bromo-2-(2-ethoxypropan-2-yl)pyrimidine
CID 155756934
(1S)-1-[2-(1-methoxy-2,2-dimethylpropyl)-4-methylpyrimidin-5-yl]ethanol
CID 103431456
N-ethyl-1-[4-methyl-2-(2-phenylpropan-2-yl)pyrimidin-5-yl]ethanamine
CID 63086419
1-[2-(2-methoxybutan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 116778873
1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine
CID 116731058
(1R)-1-[4-methyl-2-(5-methylpyrimidin-2-yl)pyrimidin-5-yl]ethanol
CID 103431340

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol?
The IUPAC name of (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol (CID 103431278) is (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol?
The canonical SMILES for (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol is CCOC(C)(C)c1ncc([C@@H](C)O)c(C)n1.
What is the InChIKey of (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol?
The InChIKey is WWCVHDJZULMHKT-SECBINFHSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-6-16-12(4,5)11-13-7-10(9(3)15)8(2)14-11/h7,9,15H,6H2,1-5H3/t9-/m1/s1.
What are the key properties of (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol?
(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol has a molecular weight of 224.30 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol is sourced from PubChem (CID 103431278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).