2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide

C18H22N2O2 — CID 54828083

IUPAC2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ccccc1OCc1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(2)20-18(21)12-19-16-10-6-7-11-17(16)22-13-15-8-4-3-5-9-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyFWUYJSRPUBNNGZ-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.20
Rot. Bonds7

About 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide

2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide (PubChem CID 54828083) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide
PubChem CID54828083
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ccccc1OCc1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(2)20-18(21)12-19-16-10-6-7-11-17(16)22-13-15-8-4-3-5-9-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21)
InChIKeyFWUYJSRPUBNNGZ-UHFFFAOYSA-N
XLogP3.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide (CID 54828083) is 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide is CC(C)NC(=O)CNc1ccccc1OCc1ccccc1.
What is the InChIKey of 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide?
The InChIKey is FWUYJSRPUBNNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14(2)20-18(21)12-19-16-10-6-7-11-17(16)22-13-15-8-4-3-5-9-15/h3-11,14,19H,12-13H2,1-2H3,(H,20,21).
What are the key properties of 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide?
2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide has a molecular weight of 298.39 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylmethoxyanilino)-N-propan-2-ylacetamide is sourced from PubChem (CID 54828083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).