2-(cyclohexylmethyl)oxetane

C10H18O — CID 162409394

IUPAC2-(cyclohexylmethyl)oxetane
SMILESC1CCC(CC2CCO2)CC1
InChIInChI=1S/C10H18O/c1-2-4-9(5-3-1)8-10-6-7-11-10/h9-10H,1-8H2
InChIKeyDZSQHRRMPBSWES-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.75
Rot. Bonds2

About 2-(cyclohexylmethyl)oxetane

2-(cyclohexylmethyl)oxetane (PubChem CID 162409394) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)oxetane.

Molecular Properties

Compound Name2-(cyclohexylmethyl)oxetane
PubChem CID162409394
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-(cyclohexylmethyl)oxetane
SMILESC1CCC(CC2CCO2)CC1
InChIInChI=1S/C10H18O/c1-2-4-9(5-3-1)8-10-6-7-11-10/h9-10H,1-8H2
InChIKeyDZSQHRRMPBSWES-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)oxetane?
The IUPAC name of 2-(cyclohexylmethyl)oxetane (CID 162409394) is 2-(cyclohexylmethyl)oxetane.
What is the SMILES notation for 2-(cyclohexylmethyl)oxetane?
The canonical SMILES for 2-(cyclohexylmethyl)oxetane is C1CCC(CC2CCO2)CC1.
What is the InChIKey of 2-(cyclohexylmethyl)oxetane?
The InChIKey is DZSQHRRMPBSWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-2-4-9(5-3-1)8-10-6-7-11-10/h9-10H,1-8H2.
What are the key properties of 2-(cyclohexylmethyl)oxetane?
2-(cyclohexylmethyl)oxetane has a molecular weight of 154.25 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)oxetane is sourced from PubChem (CID 162409394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).