2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide

C11H19NO2 — CID 63562698

IUPAC2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide
SMILESCN(CCO)C(=O)CC1=CCCCC1
InChIInChI=1S/C11H19NO2/c1-12(7-8-13)11(14)9-10-5-3-2-4-6-10/h5,13H,2-4,6-9H2,1H3
InChIKeyFVIHASYAJSYBQF-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.33
Rot. Bonds4

About 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide

2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide (PubChem CID 63562698) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide
PubChem CID63562698
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide
SMILESCN(CCO)C(=O)CC1=CCCCC1
InChIInChI=1S/C11H19NO2/c1-12(7-8-13)11(14)9-10-5-3-2-4-6-10/h5,13H,2-4,6-9H2,1H3
InChIKeyFVIHASYAJSYBQF-UHFFFAOYSA-N
XLogP1.33
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide?
The IUPAC name of 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide (CID 63562698) is 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide.
What is the SMILES notation for 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide?
The canonical SMILES for 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide is CN(CCO)C(=O)CC1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide?
The InChIKey is FVIHASYAJSYBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-12(7-8-13)11(14)9-10-5-3-2-4-6-10/h5,13H,2-4,6-9H2,1H3.
What are the key properties of 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide?
2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide has a molecular weight of 197.28 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-N-(2-hydroxyethyl)-N-methylacetamide is sourced from PubChem (CID 63562698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).