N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide

C24H25NO3 — CID 17085964

IUPACN-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)Nc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H25NO3/c1-18(2)22-13-6-7-14-23(22)28-17-24(26)25-20-11-8-12-21(15-20)27-16-19-9-4-3-5-10-19/h3-15,18H,16-17H2,1-2H3,(H,25,26)
InChIKeyUOVDSRBCYHEJIO-UHFFFAOYSA-N
MW375.47 g/mol
LogP5.41
Rot. Bonds8

About N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide

N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide (PubChem CID 17085964) has the molecular formula C24H25NO3 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide
PubChem CID17085964
Molecular FormulaC24H25NO3
Molecular Weight375.47 g/mol
Exact Mass375.18
IUPAC NameN-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)Nc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H25NO3/c1-18(2)22-13-6-7-14-23(22)28-17-24(26)25-20-11-8-12-21(15-20)27-16-19-9-4-3-5-10-19/h3-15,18H,16-17H2,1-2H3,(H,25,26)
InChIKeyUOVDSRBCYHEJIO-UHFFFAOYSA-N
XLogP5.41
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.47
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide (CID 17085964) is N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide is CC(C)c1ccccc1OCC(=O)Nc1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide?
The InChIKey is UOVDSRBCYHEJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO3/c1-18(2)22-13-6-7-14-23(22)28-17-24(26)25-20-11-8-12-21(15-20)27-16-19-9-4-3-5-10-19/h3-15,18H,16-17H2,1-2H3,(H,25,26).
What are the key properties of N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide?
N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide has a molecular weight of 375.47 g/mol, XLogP of 5.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylmethoxyphenyl)-2-(2-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 17085964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).