2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane

C9H16O2 — CID 142089797

IUPAC2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane
SMILESC[C@H]1CCCC1C1OCCO1
InChIInChI=1S/C9H16O2/c1-7-3-2-4-8(7)9-10-5-6-11-9/h7-9H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeyAZLMCTYCMDOKAS-JAMMHHFISA-N
MW156.22 g/mol
LogP1.80
Rot. Bonds1

About 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane

2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane (PubChem CID 142089797) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane.

Molecular Properties

Compound Name2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane
PubChem CID142089797
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane
SMILESC[C@H]1CCCC1C1OCCO1
InChIInChI=1S/C9H16O2/c1-7-3-2-4-8(7)9-10-5-6-11-9/h7-9H,2-6H2,1H3/t7-,8?/m0/s1
InChIKeyAZLMCTYCMDOKAS-JAMMHHFISA-N
XLogP1.80
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Dioxolane, 2-(1-ethylpentyl)-
CID 107271
2-(2-Methylhexyl)-1,3-dioxolane
CID 11970893
2-Cyclohexyl-1,3-dioxolane
CID 292653
2-(Heptan-3-yl)-4-methyl-1,3-dioxolane
CID 3737523
1,3-Dioxolane, 2-isoheptyl-
CID 110049
2-(1-Methyldecyl)-1,3-dioxolane
CID 11971393
2-Cyclopentyl-1,3-dioxolane
CID 3805992
8-Ethyl-1,4-dioxaspiro[4.4]nonane
CID 21340990
2-(1-Butylheptyl)-1,3-dioxolane
CID 11971166
2-[(4,4-Difluoro-2-propylcyclopentyl)methyl]-1,3-dioxolane
CID 167120552
2-[3-(2,4-Diethylcyclopentyl)propyl]-1,3-dioxolane
CID 23560951
2-(3-Methylhexyl)-1,3-dioxolane
CID 74325321

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane?
The IUPAC name of 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane (CID 142089797) is 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane.
What is the SMILES notation for 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane?
The canonical SMILES for 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane is C[C@H]1CCCC1C1OCCO1.
What is the InChIKey of 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane?
The InChIKey is AZLMCTYCMDOKAS-JAMMHHFISA-N. The full InChI is InChI=1S/C9H16O2/c1-7-3-2-4-8(7)9-10-5-6-11-9/h7-9H,2-6H2,1H3/t7-,8?/m0/s1.
What are the key properties of 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane?
2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane has a molecular weight of 156.22 g/mol, XLogP of 1.80, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-2-methylcyclopentyl]-1,3-dioxolane is sourced from PubChem (CID 142089797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).