2-(1-cyclopropylpentyl)oxetane

C11H20O — CID 174056372

IUPAC2-(1-cyclopropylpentyl)oxetane
SMILESCCCCC(C1CC1)C1CCO1
InChIInChI=1S/C11H20O/c1-2-3-4-10(9-5-6-9)11-7-8-12-11/h9-11H,2-8H2,1H3
InChIKeyIJGKMUQUFNCYGH-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.99
Rot. Bonds5

About 2-(1-cyclopropylpentyl)oxetane

2-(1-cyclopropylpentyl)oxetane (PubChem CID 174056372) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-(1-cyclopropylpentyl)oxetane.

Molecular Properties

Compound Name2-(1-cyclopropylpentyl)oxetane
PubChem CID174056372
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name2-(1-cyclopropylpentyl)oxetane
SMILESCCCCC(C1CC1)C1CCO1
InChIInChI=1S/C11H20O/c1-2-3-4-10(9-5-6-9)11-7-8-12-11/h9-11H,2-8H2,1H3
InChIKeyIJGKMUQUFNCYGH-UHFFFAOYSA-N
XLogP2.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylpentyl)oxetane?
The IUPAC name of 2-(1-cyclopropylpentyl)oxetane (CID 174056372) is 2-(1-cyclopropylpentyl)oxetane.
What is the SMILES notation for 2-(1-cyclopropylpentyl)oxetane?
The canonical SMILES for 2-(1-cyclopropylpentyl)oxetane is CCCCC(C1CC1)C1CCO1.
What is the InChIKey of 2-(1-cyclopropylpentyl)oxetane?
The InChIKey is IJGKMUQUFNCYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-2-3-4-10(9-5-6-9)11-7-8-12-11/h9-11H,2-8H2,1H3.
What are the key properties of 2-(1-cyclopropylpentyl)oxetane?
2-(1-cyclopropylpentyl)oxetane has a molecular weight of 168.28 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylpentyl)oxetane is sourced from PubChem (CID 174056372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).