4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide

C14H21NO3 — CID 115162917

IUPAC4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide
SMILESCOc1cc(C)cc(C)c1N(C)C(=O)CCCO
InChIInChI=1S/C14H21NO3/c1-10-8-11(2)14(12(9-10)18-4)15(3)13(17)6-5-7-16/h8-9,16H,5-7H2,1-4H3
InChIKeyIIKSISJZPXIGSZ-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.05
Rot. Bonds5

About 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide

4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide (PubChem CID 115162917) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide
PubChem CID115162917
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide
SMILESCOc1cc(C)cc(C)c1N(C)C(=O)CCCO
InChIInChI=1S/C14H21NO3/c1-10-8-11(2)14(12(9-10)18-4)15(3)13(17)6-5-7-16/h8-9,16H,5-7H2,1-4H3
InChIKeyIIKSISJZPXIGSZ-UHFFFAOYSA-N
XLogP2.05
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2,4-dimethoxy-6-methylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162936
N-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-(methylamino)acetamide
CID 82496838
(2-methoxy-4,6-dimethylphenyl)-methylcarbamic acid
CID 115170774
4-hydroxy-1-(2-methoxy-4,6-dimethylphenyl)butan-1-one
CID 96659252
N-(2,4-dimethylphenyl)-4-hydroxy-N-methylbutanamide
CID 79193265
3-amino-2-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylpropanamide
CID 115180432
3-amino-N-(2-methoxy-4,6-dimethylphenyl)-N,2-dimethylpropanamide
CID 115153589
N-methyl-4-oxo-N-(2,4,6-trimethylphenyl)pentanamide
CID 115176780
4-hydroxy-N-(4-methoxyphenyl)-N-methylbutanamide
CID 79191908
N-(4-ethoxy-3-methylphenyl)-4-hydroxy-N-methylbutanamide
CID 115162888
4-hydroxy-1-(2-methoxy-4,5-dimethylphenyl)butan-1-one
CID 94258854
N-(bromomethyl)-2-methoxy-N,4,6-trimethylaniline
CID 115261763

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide?
The IUPAC name of 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide (CID 115162917) is 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide.
What is the SMILES notation for 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide?
The canonical SMILES for 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide is COc1cc(C)cc(C)c1N(C)C(=O)CCCO.
What is the InChIKey of 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide?
The InChIKey is IIKSISJZPXIGSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-10-8-11(2)14(12(9-10)18-4)15(3)13(17)6-5-7-16/h8-9,16H,5-7H2,1-4H3.
What are the key properties of 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide?
4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide has a molecular weight of 251.33 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methoxy-4,6-dimethylphenyl)-N-methylbutanamide is sourced from PubChem (CID 115162917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).