2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide

C19H23NO3 — CID 2951611

IUPAC2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-13(2)15-5-7-16(8-6-15)20-19(21)14(3)23-18-11-9-17(22-4)10-12-18/h5-14H,1-4H3,(H,20,21)
InChIKeyVNDBWXSUIVFDQZ-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.22
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide

2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide (PubChem CID 2951611) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
PubChem CID2951611
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-13(2)15-5-7-16(8-6-15)20-19(21)14(3)23-18-11-9-17(22-4)10-12-18/h5-14H,1-4H3,(H,20,21)
InChIKeyVNDBWXSUIVFDQZ-UHFFFAOYSA-N
XLogP4.22
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide (CID 2951611) is 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide is COc1ccc(OC(C)C(=O)Nc2ccc(C(C)C)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide?
The InChIKey is VNDBWXSUIVFDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-13(2)15-5-7-16(8-6-15)20-19(21)14(3)23-18-11-9-17(22-4)10-12-18/h5-14H,1-4H3,(H,20,21).
What are the key properties of 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide?
2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide has a molecular weight of 313.40 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 2951611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).