6-cyclopropyl-4-hydroxypyran-2-one

C8H8O3 — CID 56924151

IUPAC6-cyclopropyl-4-hydroxypyran-2-one
SMILESO=c1cc(O)cc(C2CC2)o1
InChIInChI=1S/C8H8O3/c9-6-3-7(5-1-2-5)11-8(10)4-6/h3-5,9H,1-2H2
InChIKeyXGHGATJWQCRXAQ-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.22
Rot. Bonds1

About 6-cyclopropyl-4-hydroxypyran-2-one

6-cyclopropyl-4-hydroxypyran-2-one (PubChem CID 56924151) has the molecular formula C8H8O3 and a molecular weight of 152.15 g/mol. Its IUPAC name is 6-cyclopropyl-4-hydroxypyran-2-one.

Molecular Properties

Compound Name6-cyclopropyl-4-hydroxypyran-2-one
PubChem CID56924151
Molecular FormulaC8H8O3
Molecular Weight152.15 g/mol
Exact Mass152.05
IUPAC Name6-cyclopropyl-4-hydroxypyran-2-one
SMILESO=c1cc(O)cc(C2CC2)o1
InChIInChI=1S/C8H8O3/c9-6-3-7(5-1-2-5)11-8(10)4-6/h3-5,9H,1-2H2
InChIKeyXGHGATJWQCRXAQ-UHFFFAOYSA-N
XLogP1.22
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4-hydroxypyran-2-one?
The IUPAC name of 6-cyclopropyl-4-hydroxypyran-2-one (CID 56924151) is 6-cyclopropyl-4-hydroxypyran-2-one.
What is the SMILES notation for 6-cyclopropyl-4-hydroxypyran-2-one?
The canonical SMILES for 6-cyclopropyl-4-hydroxypyran-2-one is O=c1cc(O)cc(C2CC2)o1.
What is the InChIKey of 6-cyclopropyl-4-hydroxypyran-2-one?
The InChIKey is XGHGATJWQCRXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O3/c9-6-3-7(5-1-2-5)11-8(10)4-6/h3-5,9H,1-2H2.
What are the key properties of 6-cyclopropyl-4-hydroxypyran-2-one?
6-cyclopropyl-4-hydroxypyran-2-one has a molecular weight of 152.15 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4-hydroxypyran-2-one is sourced from PubChem (CID 56924151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).