4-(3-cyclohexylpropyl)morpholine

C13H25NO — CID 70222228

IUPAC4-(3-cyclohexylpropyl)morpholine
SMILESC1CCC(CCCN2CCOCC2)CC1
InChIInChI=1S/C13H25NO/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h13H,1-12H2
InChIKeyIITLXEFVXMJXGJ-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.68
Rot. Bonds4

About 4-(3-cyclohexylpropyl)morpholine

4-(3-cyclohexylpropyl)morpholine (PubChem CID 70222228) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 4-(3-cyclohexylpropyl)morpholine.

Molecular Properties

Compound Name4-(3-cyclohexylpropyl)morpholine
PubChem CID70222228
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name4-(3-cyclohexylpropyl)morpholine
SMILESC1CCC(CCCN2CCOCC2)CC1
InChIInChI=1S/C13H25NO/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h13H,1-12H2
InChIKeyIITLXEFVXMJXGJ-UHFFFAOYSA-N
XLogP2.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclohexylpropyl)morpholine?
The IUPAC name of 4-(3-cyclohexylpropyl)morpholine (CID 70222228) is 4-(3-cyclohexylpropyl)morpholine.
What is the SMILES notation for 4-(3-cyclohexylpropyl)morpholine?
The canonical SMILES for 4-(3-cyclohexylpropyl)morpholine is C1CCC(CCCN2CCOCC2)CC1.
What is the InChIKey of 4-(3-cyclohexylpropyl)morpholine?
The InChIKey is IITLXEFVXMJXGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h13H,1-12H2.
What are the key properties of 4-(3-cyclohexylpropyl)morpholine?
4-(3-cyclohexylpropyl)morpholine has a molecular weight of 211.35 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclohexylpropyl)morpholine is sourced from PubChem (CID 70222228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).