4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide

C11H19NO2 — CID 130014488

IUPAC4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide
SMILESCNC(=O)C1C(C)=CC(O)CC1(C)C
InChIInChI=1S/C11H19NO2/c1-7-5-8(13)6-11(2,3)9(7)10(14)12-4/h5,8-9,13H,6H2,1-4H3,(H,12,14)
InChIKeyCFIPTYUORNKPOF-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.09
Rot. Bonds1

About 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide

4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide (PubChem CID 130014488) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide
PubChem CID130014488
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide
SMILESCNC(=O)C1C(C)=CC(O)CC1(C)C
InChIInChI=1S/C11H19NO2/c1-7-5-8(13)6-11(2,3)9(7)10(14)12-4/h5,8-9,13H,6H2,1-4H3,(H,12,14)
InChIKeyCFIPTYUORNKPOF-UHFFFAOYSA-N
XLogP1.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide?
The IUPAC name of 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide (CID 130014488) is 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide?
The canonical SMILES for 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide is CNC(=O)C1C(C)=CC(O)CC1(C)C.
What is the InChIKey of 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide?
The InChIKey is CFIPTYUORNKPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-7-5-8(13)6-11(2,3)9(7)10(14)12-4/h5,8-9,13H,6H2,1-4H3,(H,12,14).
What are the key properties of 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide?
4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N,2,6,6-tetramethylcyclohex-2-ene-1-carboxamide is sourced from PubChem (CID 130014488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).