N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide

C13H19NO4 — CID 115178639

IUPACN-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide
SMILESCOc1ccc(N(C)C(=O)C(C)(C)O)c(OC)c1
InChIInChI=1S/C13H19NO4/c1-13(2,16)12(15)14(3)10-7-6-9(17-4)8-11(10)18-5/h6-8,16H,1-5H3
InChIKeyKUIOATLZBLSMEG-UHFFFAOYSA-N
MW253.30 g/mol
LogP1.44
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide

N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide (PubChem CID 115178639) has the molecular formula C13H19NO4 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide
PubChem CID115178639
Molecular FormulaC13H19NO4
Molecular Weight253.30 g/mol
Exact Mass253.13
IUPAC NameN-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide
SMILESCOc1ccc(N(C)C(=O)C(C)(C)O)c(OC)c1
InChIInChI=1S/C13H19NO4/c1-13(2,16)12(15)14(3)10-7-6-9(17-4)8-11(10)18-5/h6-8,16H,1-5H3
InChIKeyKUIOATLZBLSMEG-UHFFFAOYSA-N
XLogP1.44
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide
CID 115178640
2-(2,4-dimethoxy-N-methylanilino)-2-methylpropanoic acid
CID 115127855
3-(2,4-dimethoxy-N-methylanilino)-2-methyl-3-oxopropanoic acid
CID 115164190
N-(2,4-dimethoxyphenyl)-2,2,3,3,4,4,4-heptafluoro-N-(2,2,3,3,4,4,4-heptafluorobutanoyl)butanamide
CID 91727289
N-(3-fluoro-4-methoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide
CID 115178621
N-(3-ethyl-4-methoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide
CID 115178652
N-ethyl-2,4-dimethoxy-N-methylaniline
CID 115259289
2-amino-4-(2,4-dimethoxy-N-methylanilino)butanoic acid
CID 115241105
4-(2,4-dimethoxy-N-methylanilino)butanoic acid
CID 100521188
(2S)-2-(2,4-dimethoxy-N-methylanilino)butanoic acid
CID 100521202
2-(2,5-dimethoxy-N-methylanilino)-2-methylpropanoic acid
CID 115127836
2,4-dimethoxy-N-methyl-N-phenylaniline
CID 122399149

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide (CID 115178639) is N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide is COc1ccc(N(C)C(=O)C(C)(C)O)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide?
The InChIKey is KUIOATLZBLSMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO4/c1-13(2,16)12(15)14(3)10-7-6-9(17-4)8-11(10)18-5/h6-8,16H,1-5H3.
What are the key properties of N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide?
N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide has a molecular weight of 253.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-hydroxy-N,2-dimethylpropanamide is sourced from PubChem (CID 115178639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).