2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide

C19H23NO2 — CID 133210916

IUPAC2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)Cc1ccc(OC)c(C)c1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-15-10-11-18(22-3)14(2)12-15/h5-12,17H,4,13H2,1-3H3,(H,20,21)
InChIKeyVYQTXJSYEMGISV-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.81
Rot. Bonds6

About 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide

2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide (PubChem CID 133210916) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
PubChem CID133210916
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)Cc1ccc(OC)c(C)c1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-15-10-11-18(22-3)14(2)12-15/h5-12,17H,4,13H2,1-3H3,(H,20,21)
InChIKeyVYQTXJSYEMGISV-UHFFFAOYSA-N
XLogP3.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide?
The IUPAC name of 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide (CID 133210916) is 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide.
What is the SMILES notation for 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide?
The canonical SMILES for 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide is CCC(NC(=O)Cc1ccc(OC)c(C)c1)c1ccccc1.
What is the InChIKey of 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide?
The InChIKey is VYQTXJSYEMGISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-15-10-11-18(22-3)14(2)12-15/h5-12,17H,4,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide?
2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide is sourced from PubChem (CID 133210916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).