1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol

C12H23NO3 — CID 67909892

IUPAC1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol
SMILESOCC(O)(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C12H23NO3/c14-10-12(15,11-4-2-1-3-5-11)13-6-8-16-9-7-13/h11,14-15H,1-10H2
InChIKeyLZYZBUXKNNSJJB-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.58
Rot. Bonds3

About 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol

1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol (PubChem CID 67909892) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol.

Molecular Properties

Compound Name1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol
PubChem CID67909892
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol
SMILESOCC(O)(C1CCCCC1)N1CCOCC1
InChIInChI=1S/C12H23NO3/c14-10-12(15,11-4-2-1-3-5-11)13-6-8-16-9-7-13/h11,14-15H,1-10H2
InChIKeyLZYZBUXKNNSJJB-UHFFFAOYSA-N
XLogP0.58
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol?
The IUPAC name of 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol (CID 67909892) is 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol.
What is the SMILES notation for 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol?
The canonical SMILES for 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol is OCC(O)(C1CCCCC1)N1CCOCC1.
What is the InChIKey of 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol?
The InChIKey is LZYZBUXKNNSJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c14-10-12(15,11-4-2-1-3-5-11)13-6-8-16-9-7-13/h11,14-15H,1-10H2.
What are the key properties of 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol?
1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol has a molecular weight of 229.32 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-morpholin-4-ylethane-1,2-diol is sourced from PubChem (CID 67909892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).