N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide

C13H19NO3 — CID 43394122

IUPACN-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(CC(=O)NCC(C)O)ccc1C
InChIInChI=1S/C13H19NO3/c1-9-4-5-11(6-12(9)17-3)7-13(16)14-8-10(2)15/h4-6,10,15H,7-8H2,1-3H3,(H,14,16)
InChIKeyUKFVGKWEVXJMIM-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.04
Rot. Bonds5

About N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide

N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide (PubChem CID 43394122) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide
PubChem CID43394122
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(CC(=O)NCC(C)O)ccc1C
InChIInChI=1S/C13H19NO3/c1-9-4-5-11(6-12(9)17-3)7-13(16)14-8-10(2)15/h4-6,10,15H,7-8H2,1-3H3,(H,14,16)
InChIKeyUKFVGKWEVXJMIM-UHFFFAOYSA-N
XLogP1.04
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxy-4-methylphenyl)-N-[2-(methylamino)propyl]acetamide
CID 120827889
methyl 2-hydroxy-3-[[2-(3-methoxy-4-methylphenyl)acetyl]amino]propanoate
CID 103879287
N-[(2S)-2-amino-2-(4-propan-2-ylphenyl)ethyl]-2-(3-methoxy-4-methylphenyl)acetamide
CID 99815527
3-methoxy-4-[[2-(3-methoxy-4-methylphenyl)acetyl]amino]butanoic acid
CID 103153347
2-(2,4-dimethoxyphenyl)-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031383
N-(2-aminoethyl)-2-(3-methoxy-4-methylphenyl)acetamide;hydrochloride
CID 119383063
N-(2-hydroxypropyl)-2-(4-methylphenyl)acetamide
CID 43418404
N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)acetamide
CID 83032531
methyl 3-[[2-(3,4-dimethylphenyl)acetyl]amino]-2-hydroxypropanoate
CID 103957745
2-(3,4-dimethylphenyl)-N-[2-(2-hydroxypropylamino)ethyl]acetamide
CID 104593635
2-(3,4-dimethoxyphenyl)-N-(3-hydroxy-2-methylpropyl)acetamide
CID 65036986
propan-2-yl 2-(3-methoxy-4-methylphenyl)acetate
CID 112723040

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide?
The IUPAC name of N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide (CID 43394122) is N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide.
What is the SMILES notation for N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide?
The canonical SMILES for N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide is COc1cc(CC(=O)NCC(C)O)ccc1C.
What is the InChIKey of N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide?
The InChIKey is UKFVGKWEVXJMIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9-4-5-11(6-12(9)17-3)7-13(16)14-8-10(2)15/h4-6,10,15H,7-8H2,1-3H3,(H,14,16).
What are the key properties of N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide?
N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide is sourced from PubChem (CID 43394122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).