2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one

C12H20O2 — CID 65165695

IUPAC2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one
SMILESCC1C(=O)CCC1CCC1CCCO1
InChIInChI=1S/C12H20O2/c1-9-10(5-7-12(9)13)4-6-11-3-2-8-14-11/h9-11H,2-8H2,1H3
InChIKeyFYTVXQUQKGPPOZ-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.56
Rot. Bonds3

About 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one

2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one (PubChem CID 65165695) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one.

Molecular Properties

Compound Name2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one
PubChem CID65165695
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one
SMILESCC1C(=O)CCC1CCC1CCCO1
InChIInChI=1S/C12H20O2/c1-9-10(5-7-12(9)13)4-6-11-3-2-8-14-11/h9-11H,2-8H2,1H3
InChIKeyFYTVXQUQKGPPOZ-UHFFFAOYSA-N
XLogP2.56
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(oxolan-2-yl)ethyl]cyclohexan-1-one
CID 65162914
trans-(2S,3R)-3-butyl-2-methylcyclopentan-1-one
CID 124509063
2-[2-(3-bromo-2-methylcyclopentyl)ethyl]oxolane
CID 65165540
3-[3-(oxolan-2-yl)propyl]cyclopentan-1-one
CID 65165417
3-methyl-1-[3-(oxolan-2-yl)propyl]piperidin-4-one
CID 114500283
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CID 65165680
N-methyl-1-[2-[2-(oxolan-2-yl)ethyl]cyclopentyl]methanamine
CID 81034767
2-(oxolan-2-yl)ethanol;propan-2-one
CID 70356947
N-methyl-4-[2-(oxolan-2-yl)ethyl]thiolan-3-amine
CID 83196715
3-[2-(oxolan-2-yl)ethyl]cyclohept-2-en-1-one
CID 107382905
2-methyloxan-3-one
CID 11073379
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CID 65170302

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one?
The IUPAC name of 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one (CID 65165695) is 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one.
What is the SMILES notation for 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one?
The canonical SMILES for 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one is CC1C(=O)CCC1CCC1CCCO1.
What is the InChIKey of 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one?
The InChIKey is FYTVXQUQKGPPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-9-10(5-7-12(9)13)4-6-11-3-2-8-14-11/h9-11H,2-8H2,1H3.
What are the key properties of 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one?
2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one has a molecular weight of 196.29 g/mol, XLogP of 2.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one is sourced from PubChem (CID 65165695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).