cyclopentane;oxolane;pyrrolidine

C13H27NO — CID 161204353

IUPACcyclopentane;oxolane;pyrrolidine
SMILESC1CCCC1.C1CCNC1.C1CCOC1
InChIInChI=1S/C5H10.C4H9N.C4H8O/c3*1-2-4-5-3-1/h1-5H2;5H,1-4H2;1-4H2
InChIKeyUVKAHAIUGGFIFT-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.12
Rot. Bonds

About cyclopentane;oxolane;pyrrolidine

cyclopentane;oxolane;pyrrolidine (PubChem CID 161204353) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is cyclopentane;oxolane;pyrrolidine.

Molecular Properties

Compound Namecyclopentane;oxolane;pyrrolidine
PubChem CID161204353
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Namecyclopentane;oxolane;pyrrolidine
SMILESC1CCCC1.C1CCNC1.C1CCOC1
InChIInChI=1S/C5H10.C4H9N.C4H8O/c3*1-2-4-5-3-1/h1-5H2;5H,1-4H2;1-4H2
InChIKeyUVKAHAIUGGFIFT-UHFFFAOYSA-N
XLogP3.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopentane;oxolane;pyrrolidine?
The IUPAC name of cyclopentane;oxolane;pyrrolidine (CID 161204353) is cyclopentane;oxolane;pyrrolidine.
What is the SMILES notation for cyclopentane;oxolane;pyrrolidine?
The canonical SMILES for cyclopentane;oxolane;pyrrolidine is C1CCCC1.C1CCNC1.C1CCOC1.
What is the InChIKey of cyclopentane;oxolane;pyrrolidine?
The InChIKey is UVKAHAIUGGFIFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10.C4H9N.C4H8O/c3*1-2-4-5-3-1/h1-5H2;5H,1-4H2;1-4H2.
What are the key properties of cyclopentane;oxolane;pyrrolidine?
cyclopentane;oxolane;pyrrolidine has a molecular weight of 213.36 g/mol, XLogP of 3.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;oxolane;pyrrolidine is sourced from PubChem (CID 161204353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).