cyclopentyl-(2-methylfuran-3-yl)methanone

C11H14O2 — CID 104789343

IUPACcyclopentyl-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)C1CCCC1
InChIInChI=1S/C11H14O2/c1-8-10(6-7-13-8)11(12)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3
InChIKeyMMRKGRNNHYWVML-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.96
Rot. Bonds2

About cyclopentyl-(2-methylfuran-3-yl)methanone

cyclopentyl-(2-methylfuran-3-yl)methanone (PubChem CID 104789343) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is cyclopentyl-(2-methylfuran-3-yl)methanone.

Molecular Properties

Compound Namecyclopentyl-(2-methylfuran-3-yl)methanone
PubChem CID104789343
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Namecyclopentyl-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)C1CCCC1
InChIInChI=1S/C11H14O2/c1-8-10(6-7-13-8)11(12)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3
InChIKeyMMRKGRNNHYWVML-UHFFFAOYSA-N
XLogP2.96
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-bromofuran-3-yl)-cyclopentylmethanone
CID 106856555
(2-chlorofuran-3-yl)-cyclohexylmethanone
CID 106690833
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylfuran-3-carboxamide
CID 104927715
cyclobutyl 2-methylfuran-3-carboxylate
CID 130662591
2,6-dioxaspiro[4.5]decan-9-yl-(2-methylfuran-3-yl)methanone
CID 104789251
[2-(hydroxymethyl)piperidin-1-yl]-(2-methylfuran-3-yl)methanone
CID 43421327
[1-(2-methylfuran-3-carbonyl)piperidin-4-yl]-phenylmethanone
CID 18143330
N-(2-tert-butylcyclohexyl)-2-methylfuran-3-carboxamide
CID 17060539
N-(2-chloroethyl)-N-cyclopentyl-2-methylfuran-3-carboxamide
CID 55187971
cyclooctyl-(2-methylphenyl)methanone
CID 80602643
(2S,3aR,7aS)-1-(2-methylfuran-3-carbonyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 98750400
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-2-methylfuran-3-carboxamide
CID 77044866

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(2-methylfuran-3-yl)methanone?
The IUPAC name of cyclopentyl-(2-methylfuran-3-yl)methanone (CID 104789343) is cyclopentyl-(2-methylfuran-3-yl)methanone.
What is the SMILES notation for cyclopentyl-(2-methylfuran-3-yl)methanone?
The canonical SMILES for cyclopentyl-(2-methylfuran-3-yl)methanone is Cc1occc1C(=O)C1CCCC1.
What is the InChIKey of cyclopentyl-(2-methylfuran-3-yl)methanone?
The InChIKey is MMRKGRNNHYWVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-8-10(6-7-13-8)11(12)9-4-2-3-5-9/h6-7,9H,2-5H2,1H3.
What are the key properties of cyclopentyl-(2-methylfuran-3-yl)methanone?
cyclopentyl-(2-methylfuran-3-yl)methanone has a molecular weight of 178.23 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(2-methylfuran-3-yl)methanone is sourced from PubChem (CID 104789343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).