4-cyclohexylmorpholin-4-ium chloride

C10H20ClNO — CID 53447242

IUPAC4-cyclohexylmorpholin-4-ium chloride
SMILESC1CCC([NH+]2CCOCC2)CC1.[Cl-]
InChIInChI=1S/C10H19NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h10H,1-9H2;1H
InChIKeyGWOOEHDVLTWVQG-UHFFFAOYSA-N
MW205.73 g/mol
LogP-2.76
Rot. Bonds1

About 4-cyclohexylmorpholin-4-ium chloride

4-cyclohexylmorpholin-4-ium chloride (PubChem CID 53447242) has the molecular formula C10H20ClNO and a molecular weight of 205.73 g/mol. Its IUPAC name is 4-cyclohexylmorpholin-4-ium chloride.

Molecular Properties

Compound Name4-cyclohexylmorpholin-4-ium chloride
PubChem CID53447242
Molecular FormulaC10H20ClNO
Molecular Weight205.73 g/mol
Exact Mass205.12
IUPAC Name4-cyclohexylmorpholin-4-ium chloride
SMILESC1CCC([NH+]2CCOCC2)CC1.[Cl-]
InChIInChI=1S/C10H19NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h10H,1-9H2;1H
InChIKeyGWOOEHDVLTWVQG-UHFFFAOYSA-N
XLogP-2.76
TPSA13.67 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.73
LogP ≤ 5-2.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexylmorpholin-4-ium chloride?
The IUPAC name of 4-cyclohexylmorpholin-4-ium chloride (CID 53447242) is 4-cyclohexylmorpholin-4-ium chloride.
What is the SMILES notation for 4-cyclohexylmorpholin-4-ium chloride?
The canonical SMILES for 4-cyclohexylmorpholin-4-ium chloride is C1CCC([NH+]2CCOCC2)CC1.[Cl-].
What is the InChIKey of 4-cyclohexylmorpholin-4-ium chloride?
The InChIKey is GWOOEHDVLTWVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO.ClH/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;/h10H,1-9H2;1H.
What are the key properties of 4-cyclohexylmorpholin-4-ium chloride?
4-cyclohexylmorpholin-4-ium chloride has a molecular weight of 205.73 g/mol, XLogP of -2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexylmorpholin-4-ium chloride is sourced from PubChem (CID 53447242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).