2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone

C10H14O3 — CID 102651113

IUPAC2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2=CCCO2)CCC1
InChIInChI=1S/C10H14O3/c1-12-10(5-3-6-10)9(11)8-4-2-7-13-8/h4H,2-3,5-7H2,1H3
InChIKeyKBTPYDLJGYTGIP-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.43
Rot. Bonds3

About 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone

2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone (PubChem CID 102651113) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone
PubChem CID102651113
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone
SMILESCOC1(C(=O)C2=CCCO2)CCC1
InChIInChI=1S/C10H14O3/c1-12-10(5-3-6-10)9(11)8-4-2-7-13-8/h4H,2-3,5-7H2,1H3
InChIKeyKBTPYDLJGYTGIP-UHFFFAOYSA-N
XLogP1.43
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-pyran-6-yl-(1-ethoxycyclopentyl)methanone
CID 102647051
3,4-dihydro-2H-pyran-6-yl-(1-ethoxycycloheptyl)methanone
CID 102647062
2,3-dihydrofuran-5-yl-(1-methylcyclohexyl)methanone
CID 106829749
3,4-dihydro-2H-pyran-6-yl-(1-methylcyclohexyl)methanone
CID 106829748
1-(2,3-dihydrofuran-5-yl)-2-methoxyethanone
CID 102650887
cycloocten-1-yl-(4-methoxyoxan-4-yl)methanone
CID 106652262
cycloocten-1-yl-(1-methoxycyclohexyl)methanone
CID 106652256
cyclohepten-1-yl-(1-methoxycyclopentyl)methanone
CID 106652202
(3,5-dimethylphenyl)-(1-methoxycyclobutyl)methanone
CID 116706979
3,4-dihydro-2H-pyran-6-yl-(2-methyloxan-2-yl)methanone
CID 102646988
(1-methoxycyclobutyl)-(2,4,5-trimethylphenyl)methanone
CID 116706943
(4-tert-butylphenyl)-(1-methoxycyclobutyl)methanone
CID 116706927

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone (CID 102651113) is 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone is COC1(C(=O)C2=CCCO2)CCC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone?
The InChIKey is KBTPYDLJGYTGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-12-10(5-3-6-10)9(11)8-4-2-7-13-8/h4H,2-3,5-7H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone?
2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone has a molecular weight of 182.22 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(1-methoxycyclobutyl)methanone is sourced from PubChem (CID 102651113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).