[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol

C9H16O3 — CID 15324211

IUPAC[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol
SMILESOCC1(C2OCCO2)CCCC1
InChIInChI=1S/C9H16O3/c10-7-9(3-1-2-4-9)8-11-5-6-12-8/h8,10H,1-7H2
InChIKeySMCLQPASHNHFSW-UHFFFAOYSA-N
MW172.22 g/mol
LogP0.91
Rot. Bonds2

About [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol

[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol (PubChem CID 15324211) has the molecular formula C9H16O3 and a molecular weight of 172.22 g/mol. Its IUPAC name is [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol
PubChem CID15324211
Molecular FormulaC9H16O3
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol
SMILESOCC1(C2OCCO2)CCCC1
InChIInChI=1S/C9H16O3/c10-7-9(3-1-2-4-9)8-11-5-6-12-8/h8,10H,1-7H2
InChIKeySMCLQPASHNHFSW-UHFFFAOYSA-N
XLogP0.91
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol?
The IUPAC name of [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol (CID 15324211) is [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol?
The canonical SMILES for [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol is OCC1(C2OCCO2)CCCC1.
What is the InChIKey of [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol?
The InChIKey is SMCLQPASHNHFSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O3/c10-7-9(3-1-2-4-9)8-11-5-6-12-8/h8,10H,1-7H2.
What are the key properties of [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol?
[1-(1,3-dioxolan-2-yl)cyclopentyl]methanol has a molecular weight of 172.22 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-dioxolan-2-yl)cyclopentyl]methanol is sourced from PubChem (CID 15324211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).