2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide

C14H21NO3 — CID 115178746

IUPAC2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide
SMILESCOc1cc(C)c(CNC(=O)C(C)(C)O)cc1C
InChIInChI=1S/C14H21NO3/c1-9-7-12(18-5)10(2)6-11(9)8-15-13(16)14(3,4)17/h6-7,17H,8H2,1-5H3,(H,15,16)
InChIKeyGNFDWALIOTZCRS-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.70
Rot. Bonds4

About 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide

2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide (PubChem CID 115178746) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide
PubChem CID115178746
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide
SMILESCOc1cc(C)c(CNC(=O)C(C)(C)O)cc1C
InChIInChI=1S/C14H21NO3/c1-9-7-12(18-5)10(2)6-11(9)8-15-13(16)14(3,4)17/h6-7,17H,8H2,1-5H3,(H,15,16)
InChIKeyGNFDWALIOTZCRS-UHFFFAOYSA-N
XLogP1.70
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,2-trifluoro-N-[(4-methoxy-2,5-dimethylphenyl)methyl]acetamide
CID 115190244
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-3-oxobutanamide
CID 115176376
N-[(2,5-dimethoxy-4-methylphenyl)methyl]-3,3-dimethylbutanamide
CID 110783154
ethyl 2-[(4-methoxy-2,5-dimethylphenyl)methylamino]-2-oxoacetate
CID 115141968
N-[(4,5-dimethoxy-2-methylphenyl)methyl]carbamoyl bromide
CID 115193611
N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780829
N-[(2,5-dimethoxy-4-methylphenyl)methyl]carbamoyl chloride
CID 115194658
N-[(4-amino-5-methoxy-2-methylphenyl)methyl]-2,2,2-trifluoroacetamide
CID 122629173
1-amino-3-[(4,5-dimethoxy-2-methylphenyl)methyl]urea
CID 115192661
methyl 2-[(4-methoxy-2,5-dimethylphenyl)methylamino]acetate
CID 115232862
1-[(4-methoxy-2,5-dimethylphenyl)methylamino]propan-2-one
CID 115234701
1-cyano-N-[(4,5-dimethoxy-2-methylphenyl)methyl]formamide
CID 115172196

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide?
The IUPAC name of 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide (CID 115178746) is 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide.
What is the SMILES notation for 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide?
The canonical SMILES for 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide is COc1cc(C)c(CNC(=O)C(C)(C)O)cc1C.
What is the InChIKey of 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide?
The InChIKey is GNFDWALIOTZCRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-9-7-12(18-5)10(2)6-11(9)8-15-13(16)14(3,4)17/h6-7,17H,8H2,1-5H3,(H,15,16).
What are the key properties of 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide?
2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide has a molecular weight of 251.33 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(4-methoxy-2,5-dimethylphenyl)methyl]-2-methylpropanamide is sourced from PubChem (CID 115178746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).