2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide

C19H22N2O3 — CID 9163146

IUPAC2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-2-12-20-18(22)13-21-19(23)14-24-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyHIFIVNDJEHGHIK-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.37
Rot. Bonds8

About 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide

2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide (PubChem CID 9163146) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide
PubChem CID9163146
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide
SMILESCCCNC(=O)CNC(=O)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-2-12-20-18(22)13-21-19(23)14-24-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyHIFIVNDJEHGHIK-UHFFFAOYSA-N
XLogP2.37
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

diethyl-[2-[[2-(4-phenylphenoxy)acetyl]amino]ethyl]azanium
CID 6998960
N-propyl-2-[[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]acetamide
CID 8510023
N-[2-[[2-(4-methylphenoxy)acetyl]amino]ethyl]-4-phenylbenzamide
CID 108538441
N-[2-[2-[[2-(4-methylphenoxy)acetyl]amino]ethylamino]-2-oxoethyl]benzamide
CID 108539308
N-ethyl-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]acetamide
CID 9224487
2-(4-formylphenoxy)acetic acid;2-(4-formylphenoxy)-N-propylacetamide
CID 159419255
2-[[2-(2-chlorophenoxy)acetyl]amino]-N-propylacetamide
CID 9011744
N-(3-aminobutyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 119497991
2-[[2-(4-anilinophenoxy)acetyl]amino]-N-ethylacetamide
CID 18145615
2-(4-phenylanilino)-N-propylacetamide
CID 47117859
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
2-[[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]amino]-N-propylacetamide
CID 9163185

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide?
The IUPAC name of 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide (CID 9163146) is 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide.
What is the SMILES notation for 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide?
The canonical SMILES for 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide is CCCNC(=O)CNC(=O)COc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide?
The InChIKey is HIFIVNDJEHGHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-2-12-20-18(22)13-21-19(23)14-24-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide?
2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide has a molecular weight of 326.40 g/mol, XLogP of 2.37, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-phenylphenoxy)acetyl]amino]-N-propylacetamide is sourced from PubChem (CID 9163146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).