N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide

C17H19NO4 — CID 78783405

IUPACN-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide
SMILESCCCOc1ccc(OCC(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO4/c1-2-10-21-15-6-8-16(9-7-15)22-12-17(20)18-13-4-3-5-14(19)11-13/h3-9,11,19H,2,10,12H2,1H3,(H,18,20)
InChIKeyCTWQGBDWVNOKFT-UHFFFAOYSA-N
MW301.34 g/mol
LogP3.20
Rot. Bonds7

About N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide

N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide (PubChem CID 78783405) has the molecular formula C17H19NO4 and a molecular weight of 301.34 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide
PubChem CID78783405
Molecular FormulaC17H19NO4
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC NameN-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide
SMILESCCCOc1ccc(OCC(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO4/c1-2-10-21-15-6-8-16(9-7-15)22-12-17(20)18-13-4-3-5-14(19)11-13/h3-9,11,19H,2,10,12H2,1H3,(H,18,20)
InChIKeyCTWQGBDWVNOKFT-UHFFFAOYSA-N
XLogP3.20
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenoxy)-N-(3-hydroxyphenyl)acetamide
CID 6458581
2-(4-bromophenoxy)-N-(3-propoxyphenyl)acetamide
CID 17096693
N,N-diethyl-3-[[2-(4-propoxyphenoxy)acetyl]amino]benzamide
CID 78775457
2-(3-hydroxyphenyl)-N-(4-propoxyphenyl)acetamide
CID 62327820
methyl 2-[[3-[[2-(4-propoxyphenoxy)acetyl]amino]benzoyl]amino]acetate
CID 55750199
N-(4-methoxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 4732668
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007
2-ethoxy-N-(3-hydroxyphenyl)acetamide
CID 28780663
4-butoxy-N-[3-[(2-phenoxyacetyl)amino]phenyl]benzamide
CID 17231371
2-(3-propoxyphenoxy)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 4733098
2-[4-(1-adamantyl)phenoxy]-N-(3-hydroxyphenyl)acetamide
CID 24811214
N-[3-(bromomethyl)phenyl]-2-(4-hexadecoxyphenoxy)acetamide
CID 10053531

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide?
The IUPAC name of N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide (CID 78783405) is N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide?
The canonical SMILES for N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide is CCCOc1ccc(OCC(=O)Nc2cccc(O)c2)cc1.
What is the InChIKey of N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide?
The InChIKey is CTWQGBDWVNOKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4/c1-2-10-21-15-6-8-16(9-7-15)22-12-17(20)18-13-4-3-5-14(19)11-13/h3-9,11,19H,2,10,12H2,1H3,(H,18,20).
What are the key properties of N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide?
N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide has a molecular weight of 301.34 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-2-(4-propoxyphenoxy)acetamide is sourced from PubChem (CID 78783405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).