(1-hydroxycyclohexyl)-morpholin-4-ylmethanone

C11H19NO3 — CID 121220668

IUPAC(1-hydroxycyclohexyl)-morpholin-4-ylmethanone
SMILESO=C(N1CCOCC1)C1(O)CCCCC1
InChIInChI=1S/C11H19NO3/c13-10(12-6-8-15-9-7-12)11(14)4-2-1-3-5-11/h14H,1-9H2
InChIKeyDFWWPTGEFPAIIR-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.54
Rot. Bonds1

About (1-hydroxycyclohexyl)-morpholin-4-ylmethanone

(1-hydroxycyclohexyl)-morpholin-4-ylmethanone (PubChem CID 121220668) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is (1-hydroxycyclohexyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1-hydroxycyclohexyl)-morpholin-4-ylmethanone
PubChem CID121220668
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name(1-hydroxycyclohexyl)-morpholin-4-ylmethanone
SMILESO=C(N1CCOCC1)C1(O)CCCCC1
InChIInChI=1S/C11H19NO3/c13-10(12-6-8-15-9-7-12)11(14)4-2-1-3-5-11/h14H,1-9H2
InChIKeyDFWWPTGEFPAIIR-UHFFFAOYSA-N
XLogP0.54
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-hydroxycyclohexyl)-morpholin-4-ylmethanone?
The IUPAC name of (1-hydroxycyclohexyl)-morpholin-4-ylmethanone (CID 121220668) is (1-hydroxycyclohexyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1-hydroxycyclohexyl)-morpholin-4-ylmethanone?
The canonical SMILES for (1-hydroxycyclohexyl)-morpholin-4-ylmethanone is O=C(N1CCOCC1)C1(O)CCCCC1.
What is the InChIKey of (1-hydroxycyclohexyl)-morpholin-4-ylmethanone?
The InChIKey is DFWWPTGEFPAIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c13-10(12-6-8-15-9-7-12)11(14)4-2-1-3-5-11/h14H,1-9H2.
What are the key properties of (1-hydroxycyclohexyl)-morpholin-4-ylmethanone?
(1-hydroxycyclohexyl)-morpholin-4-ylmethanone has a molecular weight of 213.28 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-hydroxycyclohexyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 121220668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).