N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide

C11H23NO2 — CID 64555967

IUPACN-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide
SMILESCCC(C)(CO)NC(=O)CC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-6-11(5,8-13)12-9(14)7-10(2,3)4/h13H,6-8H2,1-5H3,(H,12,14)
InChIKeyNNEQULUCSDVQDZ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds4

About N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide

N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide (PubChem CID 64555967) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide
PubChem CID64555967
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide
SMILESCCC(C)(CO)NC(=O)CC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-6-11(5,8-13)12-9(14)7-10(2,3)4/h13H,6-8H2,1-5H3,(H,12,14)
InChIKeyNNEQULUCSDVQDZ-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide 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 N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide (CID 64555967) is N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide is CCC(C)(CO)NC(=O)CC(C)(C)C.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide?
The InChIKey is NNEQULUCSDVQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-6-11(5,8-13)12-9(14)7-10(2,3)4/h13H,6-8H2,1-5H3,(H,12,14).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide?
N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide has a molecular weight of 201.31 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 64555967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).