N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide

C16H28N2O3 — CID 53244978

IUPACN-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide
SMILESCCN1CC(C)(C)OC(=O)C1CC(=O)NC1CCCCC1
InChIInChI=1S/C16H28N2O3/c1-4-18-11-16(2,3)21-15(20)13(18)10-14(19)17-12-8-6-5-7-9-12/h12-13H,4-11H2,1-3H3,(H,17,19)
InChIKeyFYRYGYGIMSVCKQ-UHFFFAOYSA-N
MW296.41 g/mol
LogP1.85
Rot. Bonds4

About N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide

N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide (PubChem CID 53244978) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide
PubChem CID53244978
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC NameN-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide
SMILESCCN1CC(C)(C)OC(=O)C1CC(=O)NC1CCCCC1
InChIInChI=1S/C16H28N2O3/c1-4-18-11-16(2,3)21-15(20)13(18)10-14(19)17-12-8-6-5-7-9-12/h12-13H,4-11H2,1-3H3,(H,17,19)
InChIKeyFYRYGYGIMSVCKQ-UHFFFAOYSA-N
XLogP1.85
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide (CID 53244978) is N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide is CCN1CC(C)(C)OC(=O)C1CC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide?
The InChIKey is FYRYGYGIMSVCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-4-18-11-16(2,3)21-15(20)13(18)10-14(19)17-12-8-6-5-7-9-12/h12-13H,4-11H2,1-3H3,(H,17,19).
What are the key properties of N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide?
N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide has a molecular weight of 296.41 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(4-ethyl-6,6-dimethyl-2-oxomorpholin-3-yl)acetamide is sourced from PubChem (CID 53244978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).