2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide

C18H21NO3 — CID 2789587

IUPAC2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide
SMILESCOc1ccc(OC(C)C(=O)NC(C)c2ccccc2)cc1
InChIInChI=1S/C18H21NO3/c1-13(15-7-5-4-6-8-15)19-18(20)14(2)22-17-11-9-16(21-3)10-12-17/h4-14H,1-3H3,(H,19,20)
InChIKeyACZCCNWVCRQVLB-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.34
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide

2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide (PubChem CID 2789587) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide
PubChem CID2789587
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide
SMILESCOc1ccc(OC(C)C(=O)NC(C)c2ccccc2)cc1
InChIInChI=1S/C18H21NO3/c1-13(15-7-5-4-6-8-15)19-18(20)14(2)22-17-11-9-16(21-3)10-12-17/h4-14H,1-3H3,(H,19,20)
InChIKeyACZCCNWVCRQVLB-UHFFFAOYSA-N
XLogP3.34
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.34
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-(1-phenylethyl)propanamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide (CID 2789587) is 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide is COc1ccc(OC(C)C(=O)NC(C)c2ccccc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide?
The InChIKey is ACZCCNWVCRQVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13(15-7-5-4-6-8-15)19-18(20)14(2)22-17-11-9-16(21-3)10-12-17/h4-14H,1-3H3,(H,19,20).
What are the key properties of 2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide?
2-(4-methoxyphenoxy)-N-(1-phenylethyl)propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.34, 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-(1-phenylethyl)propanamide is sourced from PubChem (CID 2789587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).