3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide

C14H21NO4 — CID 78855932

IUPAC3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide
SMILESCOc1ccc(OC)c(CCC(=O)NCC(C)O)c1
InChIInChI=1S/C14H21NO4/c1-10(16)9-15-14(17)7-4-11-8-12(18-2)5-6-13(11)19-3/h5-6,8,10,16H,4,7,9H2,1-3H3,(H,15,17)
InChIKeyGMWSRSDASYDGDW-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.13
Rot. Bonds7

About 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide

3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide (PubChem CID 78855932) has the molecular formula C14H21NO4 and a molecular weight of 267.32 g/mol. Its IUPAC name is 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide.

Molecular Properties

Compound Name3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide
PubChem CID78855932
Molecular FormulaC14H21NO4
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide
SMILESCOc1ccc(OC)c(CCC(=O)NCC(C)O)c1
InChIInChI=1S/C14H21NO4/c1-10(16)9-15-14(17)7-4-11-8-12(18-2)5-6-13(11)19-3/h5-6,8,10,16H,4,7,9H2,1-3H3,(H,15,17)
InChIKeyGMWSRSDASYDGDW-UHFFFAOYSA-N
XLogP1.13
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,5-dimethoxyphenyl)-N-[(2R)-2-(ethylamino)propyl]propanamide
CID 120650953
2-[[3-(2,5-dimethoxyphenyl)propanoylamino]methyl]-4-methylpentanoic acid
CID 119253559
2-(2,4-dimethoxyphenyl)-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031383
3-(2,5-dimethoxyphenyl)-N-(3-methylbutan-2-yl)propanamide
CID 43048906
N-(2-acetamidoethyl)-3-(2,5-dimethoxyphenyl)propanamide
CID 38004607
N-(2-aminoethyl)-3-(2,5-dimethoxyphenyl)propanamide
CID 94690716
2-benzyl-3-[3-(2,5-dimethoxyphenyl)propanoylamino]propanoic acid
CID 119233953
3-(2,5-dimethoxyphenyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]propanamide
CID 38501975
N-(2-amino-2-ethylbutyl)-3-(2,5-dimethoxyphenyl)propanamide
CID 119639750
3-(2,5-dimethoxyphenyl)-N-[1-(5-methylfuran-2-yl)ethyl]propanamide
CID 134046801
3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide
CID 46539482
3-(2,5-dimethoxyphenyl)propanoyl chloride
CID 121219721

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide?
The IUPAC name of 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide (CID 78855932) is 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide.
What is the SMILES notation for 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide?
The canonical SMILES for 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide is COc1ccc(OC)c(CCC(=O)NCC(C)O)c1.
What is the InChIKey of 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide?
The InChIKey is GMWSRSDASYDGDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO4/c1-10(16)9-15-14(17)7-4-11-8-12(18-2)5-6-13(11)19-3/h5-6,8,10,16H,4,7,9H2,1-3H3,(H,15,17).
What are the key properties of 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide?
3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide has a molecular weight of 267.32 g/mol, XLogP of 1.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide is sourced from PubChem (CID 78855932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).