(4R)-4-ethyl-2,3-dihydropyran-4-ol

C7H12O2 — CID 174586588

IUPAC(4R)-4-ethyl-2,3-dihydropyran-4-ol
SMILESCC[C@]1(O)C=COCC1
InChIInChI=1S/C7H12O2/c1-2-7(8)3-5-9-6-4-7/h3,5,8H,2,4,6H2,1H3/t7-/m0/s1
InChIKeyIIWCTARWMPYNNH-ZETCQYMHSA-N
MW128.17 g/mol
LogP1.06
Rot. Bonds1

About (4R)-4-ethyl-2,3-dihydropyran-4-ol

(4R)-4-ethyl-2,3-dihydropyran-4-ol (PubChem CID 174586588) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is (4R)-4-ethyl-2,3-dihydropyran-4-ol.

Molecular Properties

Compound Name(4R)-4-ethyl-2,3-dihydropyran-4-ol
PubChem CID174586588
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name(4R)-4-ethyl-2,3-dihydropyran-4-ol
SMILESCC[C@]1(O)C=COCC1
InChIInChI=1S/C7H12O2/c1-2-7(8)3-5-9-6-4-7/h3,5,8H,2,4,6H2,1H3/t7-/m0/s1
InChIKeyIIWCTARWMPYNNH-ZETCQYMHSA-N
XLogP1.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-4-ethyl-2,3-dihydropyran-4-ol 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 (4R)-4-ethyl-2,3-dihydropyran-4-ol?
The IUPAC name of (4R)-4-ethyl-2,3-dihydropyran-4-ol (CID 174586588) is (4R)-4-ethyl-2,3-dihydropyran-4-ol.
What is the SMILES notation for (4R)-4-ethyl-2,3-dihydropyran-4-ol?
The canonical SMILES for (4R)-4-ethyl-2,3-dihydropyran-4-ol is CC[C@]1(O)C=COCC1.
What is the InChIKey of (4R)-4-ethyl-2,3-dihydropyran-4-ol?
The InChIKey is IIWCTARWMPYNNH-ZETCQYMHSA-N. The full InChI is InChI=1S/C7H12O2/c1-2-7(8)3-5-9-6-4-7/h3,5,8H,2,4,6H2,1H3/t7-/m0/s1.
What are the key properties of (4R)-4-ethyl-2,3-dihydropyran-4-ol?
(4R)-4-ethyl-2,3-dihydropyran-4-ol has a molecular weight of 128.17 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-ethyl-2,3-dihydropyran-4-ol is sourced from PubChem (CID 174586588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).