4-(cyclopentylmethyl)-2H-furan-5-one

C10H14O2 — CID 141001109

IUPAC4-(cyclopentylmethyl)-2H-furan-5-one
SMILESO=C1OCC=C1CC1CCCC1
InChIInChI=1S/C10H14O2/c11-10-9(5-6-12-10)7-8-3-1-2-4-8/h5,8H,1-4,6-7H2
InChIKeyFIBUBSNSIOBRRT-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.05
Rot. Bonds2

About 4-(cyclopentylmethyl)-2H-furan-5-one

4-(cyclopentylmethyl)-2H-furan-5-one (PubChem CID 141001109) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 4-(cyclopentylmethyl)-2H-furan-5-one.

Molecular Properties

Compound Name4-(cyclopentylmethyl)-2H-furan-5-one
PubChem CID141001109
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name4-(cyclopentylmethyl)-2H-furan-5-one
SMILESO=C1OCC=C1CC1CCCC1
InChIInChI=1S/C10H14O2/c11-10-9(5-6-12-10)7-8-3-1-2-4-8/h5,8H,1-4,6-7H2
InChIKeyFIBUBSNSIOBRRT-UHFFFAOYSA-N
XLogP2.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylmethyl)-2H-furan-5-one?
The IUPAC name of 4-(cyclopentylmethyl)-2H-furan-5-one (CID 141001109) is 4-(cyclopentylmethyl)-2H-furan-5-one.
What is the SMILES notation for 4-(cyclopentylmethyl)-2H-furan-5-one?
The canonical SMILES for 4-(cyclopentylmethyl)-2H-furan-5-one is O=C1OCC=C1CC1CCCC1.
What is the InChIKey of 4-(cyclopentylmethyl)-2H-furan-5-one?
The InChIKey is FIBUBSNSIOBRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c11-10-9(5-6-12-10)7-8-3-1-2-4-8/h5,8H,1-4,6-7H2.
What are the key properties of 4-(cyclopentylmethyl)-2H-furan-5-one?
4-(cyclopentylmethyl)-2H-furan-5-one has a molecular weight of 166.22 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylmethyl)-2H-furan-5-one is sourced from PubChem (CID 141001109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).