cyclopenta[c]pyran

C8H6O — CID 14144377

IUPACcyclopenta[c]pyran
SMILESc1cc2ccocc-2c1
InChIInChI=1S/C8H6O/c1-2-7-4-5-9-6-8(7)3-1/h1-6H
InChIKeyUBKHHFOBCZFFKL-UHFFFAOYSA-N
MW118.13 g/mol
LogP2.38
Rot. Bonds

About cyclopenta[c]pyran

cyclopenta[c]pyran (PubChem CID 14144377) has the molecular formula C8H6O and a molecular weight of 118.13 g/mol. Its IUPAC name is cyclopenta[c]pyran.

Molecular Properties

Compound Namecyclopenta[c]pyran
PubChem CID14144377
Molecular FormulaC8H6O
Molecular Weight118.13 g/mol
Exact Mass118.04
IUPAC Namecyclopenta[c]pyran
SMILESc1cc2ccocc-2c1
InChIInChI=1S/C8H6O/c1-2-7-4-5-9-6-8(7)3-1/h1-6H
InChIKeyUBKHHFOBCZFFKL-UHFFFAOYSA-N
XLogP2.38
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopenta[c]pyran?
The IUPAC name of cyclopenta[c]pyran (CID 14144377) is cyclopenta[c]pyran.
What is the SMILES notation for cyclopenta[c]pyran?
The canonical SMILES for cyclopenta[c]pyran is c1cc2ccocc-2c1.
What is the InChIKey of cyclopenta[c]pyran?
The InChIKey is UBKHHFOBCZFFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O/c1-2-7-4-5-9-6-8(7)3-1/h1-6H.
What are the key properties of cyclopenta[c]pyran?
cyclopenta[c]pyran has a molecular weight of 118.13 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta[c]pyran is sourced from PubChem (CID 14144377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).