N-[acetamido(phenyl)methyl]acetamide

C11H14N2O2 — CID 23346

IUPACN-[acetamido(phenyl)methyl]acetamide
SMILESCC(=O)NC(NC(C)=O)c1ccccc1
InChIInChI=1S/C11H14N2O2/c1-8(14)12-11(13-9(2)15)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,12,14)(H,13,15)
InChIKeyJFUUKHUKGAQKIW-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.96
Rot. Bonds3

About N-[acetamido(phenyl)methyl]acetamide

N-[acetamido(phenyl)methyl]acetamide (PubChem CID 23346) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is N-[acetamido(phenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[acetamido(phenyl)methyl]acetamide
PubChem CID23346
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC NameN-[acetamido(phenyl)methyl]acetamide
SMILESCC(=O)NC(NC(C)=O)c1ccccc1
InChIInChI=1S/C11H14N2O2/c1-8(14)12-11(13-9(2)15)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,12,14)(H,13,15)
InChIKeyJFUUKHUKGAQKIW-UHFFFAOYSA-N
XLogP0.96
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[acetamido(phenyl)methyl]acetamide?
The IUPAC name of N-[acetamido(phenyl)methyl]acetamide (CID 23346) is N-[acetamido(phenyl)methyl]acetamide.
What is the SMILES notation for N-[acetamido(phenyl)methyl]acetamide?
The canonical SMILES for N-[acetamido(phenyl)methyl]acetamide is CC(=O)NC(NC(C)=O)c1ccccc1.
What is the InChIKey of N-[acetamido(phenyl)methyl]acetamide?
The InChIKey is JFUUKHUKGAQKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-8(14)12-11(13-9(2)15)10-6-4-3-5-7-10/h3-7,11H,1-2H3,(H,12,14)(H,13,15).
What are the key properties of N-[acetamido(phenyl)methyl]acetamide?
N-[acetamido(phenyl)methyl]acetamide has a molecular weight of 206.24 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[acetamido(phenyl)methyl]acetamide is sourced from PubChem (CID 23346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).