4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide

C14H21NO3 — CID 79203586

IUPAC4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide
SMILESCOc1c(C)ccc(NC(=O)CCC(C)O)c1C
InChIInChI=1S/C14H21NO3/c1-9-5-7-12(11(3)14(9)18-4)15-13(17)8-6-10(2)16/h5,7,10,16H,6,8H2,1-4H3,(H,15,17)
InChIKeyGNXJFLSBYCXWBU-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.41
Rot. Bonds5

About 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide

4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide (PubChem CID 79203586) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide
PubChem CID79203586
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide
SMILESCOc1c(C)ccc(NC(=O)CCC(C)O)c1C
InChIInChI=1S/C14H21NO3/c1-9-5-7-12(11(3)14(9)18-4)15-13(17)8-6-10(2)16/h5,7,10,16H,6,8H2,1-4H3,(H,15,17)
InChIKeyGNXJFLSBYCXWBU-UHFFFAOYSA-N
XLogP2.41
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methoxy-2,4-dimethylanilino)-4-oxobutanoic acid
CID 54868313
N-(3-methoxy-2,4-dimethylphenyl)-4-(methylamino)butanamide
CID 60842237
N-(3-methoxy-2,4-dimethylphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119728792
4-(3-methoxy-2,4-dimethylanilino)-2,3-dimethyl-4-oxobutanoic acid
CID 103497339
(2R)-2-amino-N-(3-methoxy-2,4-dimethylphenyl)-3-methylbutanamide
CID 79011717
4-hydroxy-N-(2-methylphenyl)pentanamide
CID 79017195
N-(3-methoxy-2,4-dimethylphenyl)-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611343
N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide
CID 79192494
2,2,2-trifluoro-N-(3-methoxy-2,4-dimethylphenyl)acetamide
CID 62726523
N-(3-methoxy-2,4-dimethylphenyl)prop-2-enamide
CID 43696159
N-(4-ethoxy-2-methylphenyl)-4-hydroxypentanamide
CID 79205094
N-(4-methoxy-2,3,5-trimethylphenyl)-3-(methylamino)propanamide
CID 96676162

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide (CID 79203586) is 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide is COc1c(C)ccc(NC(=O)CCC(C)O)c1C.
What is the InChIKey of 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide?
The InChIKey is GNXJFLSBYCXWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-9-5-7-12(11(3)14(9)18-4)15-13(17)8-6-10(2)16/h5,7,10,16H,6,8H2,1-4H3,(H,15,17).
What are the key properties of 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide?
4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide has a molecular weight of 251.33 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide is sourced from PubChem (CID 79203586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).