1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone

C15H27NO2 — CID 58394969

IUPAC1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone
SMILESCC(C)C1CCC(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H27NO2/c1-12(2)14-5-3-13(4-6-14)11-15(17)16-7-9-18-10-8-16/h12-14H,3-11H2,1-2H3
InChIKeyVIISPYRAOIVKFF-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.70
Rot. Bonds3

About 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone

1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone (PubChem CID 58394969) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone
PubChem CID58394969
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone
SMILESCC(C)C1CCC(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C15H27NO2/c1-12(2)14-5-3-13(4-6-14)11-15(17)16-7-9-18-10-8-16/h12-14H,3-11H2,1-2H3
InChIKeyVIISPYRAOIVKFF-UHFFFAOYSA-N
XLogP2.70
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone (CID 58394969) is 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone is CC(C)C1CCC(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone?
The InChIKey is VIISPYRAOIVKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-12(2)14-5-3-13(4-6-14)11-15(17)16-7-9-18-10-8-16/h12-14H,3-11H2,1-2H3.
What are the key properties of 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone?
1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone has a molecular weight of 253.39 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone is sourced from PubChem (CID 58394969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).