N-(2-methylpropyl)-2-phenoxyacetamide

C12H17NO2 — CID 879323

IUPACN-(2-methylpropyl)-2-phenoxyacetamide
SMILESCC(C)CNC(=O)COc1ccccc1
InChIInChI=1S/C12H17NO2/c1-10(2)8-13-12(14)9-15-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)
InChIKeyQGBJXQHNVQLWEB-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.84
Rot. Bonds5

About N-(2-methylpropyl)-2-phenoxyacetamide

N-(2-methylpropyl)-2-phenoxyacetamide (PubChem CID 879323) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-phenoxyacetamide
PubChem CID879323
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-(2-methylpropyl)-2-phenoxyacetamide
SMILESCC(C)CNC(=O)COc1ccccc1
InChIInChI=1S/C12H17NO2/c1-10(2)8-13-12(14)9-15-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)
InChIKeyQGBJXQHNVQLWEB-UHFFFAOYSA-N
XLogP1.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-phenoxyacetamide?
The IUPAC name of N-(2-methylpropyl)-2-phenoxyacetamide (CID 879323) is N-(2-methylpropyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2-methylpropyl)-2-phenoxyacetamide is CC(C)CNC(=O)COc1ccccc1.
What is the InChIKey of N-(2-methylpropyl)-2-phenoxyacetamide?
The InChIKey is QGBJXQHNVQLWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-10(2)8-13-12(14)9-15-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14).
What are the key properties of N-(2-methylpropyl)-2-phenoxyacetamide?
N-(2-methylpropyl)-2-phenoxyacetamide has a molecular weight of 207.27 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-phenoxyacetamide is sourced from PubChem (CID 879323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).