1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol

C11H20O3 — CID 14905210

IUPAC1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol
SMILESOC1(CCCC2OCCO2)CCCC1
InChIInChI=1S/C11H20O3/c12-11(5-1-2-6-11)7-3-4-10-13-8-9-14-10/h10,12H,1-9H2
InChIKeyAQRCHUBUUNBEKM-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.83
Rot. Bonds4

About 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol

1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol (PubChem CID 14905210) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol
PubChem CID14905210
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol
SMILESOC1(CCCC2OCCO2)CCCC1
InChIInChI=1S/C11H20O3/c12-11(5-1-2-6-11)7-3-4-10-13-8-9-14-10/h10,12H,1-9H2
InChIKeyAQRCHUBUUNBEKM-UHFFFAOYSA-N
XLogP1.83
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol?
The IUPAC name of 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol (CID 14905210) is 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol?
The canonical SMILES for 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol is OC1(CCCC2OCCO2)CCCC1.
What is the InChIKey of 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol?
The InChIKey is AQRCHUBUUNBEKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c12-11(5-1-2-6-11)7-3-4-10-13-8-9-14-10/h10,12H,1-9H2.
What are the key properties of 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol?
1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol has a molecular weight of 200.28 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(1,3-dioxolan-2-yl)propyl]cyclopentan-1-ol is sourced from PubChem (CID 14905210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).