N-(1-phenylpropan-2-ylcarbamoyl)acetamide

C12H16N2O2 — CID 3745242

IUPACN-(1-phenylpropan-2-ylcarbamoyl)acetamide
SMILESCC(=O)NC(=O)NC(C)Cc1ccccc1
InChIInChI=1S/C12H16N2O2/c1-9(13-12(16)14-10(2)15)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H2,13,14,15,16)
InChIKeyUSQGOFZXYLOQKI-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.46
Rot. Bonds3

About N-(1-phenylpropan-2-ylcarbamoyl)acetamide

N-(1-phenylpropan-2-ylcarbamoyl)acetamide (PubChem CID 3745242) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(1-phenylpropan-2-ylcarbamoyl)acetamide.

Molecular Properties

Compound NameN-(1-phenylpropan-2-ylcarbamoyl)acetamide
PubChem CID3745242
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(1-phenylpropan-2-ylcarbamoyl)acetamide
SMILESCC(=O)NC(=O)NC(C)Cc1ccccc1
InChIInChI=1S/C12H16N2O2/c1-9(13-12(16)14-10(2)15)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H2,13,14,15,16)
InChIKeyUSQGOFZXYLOQKI-UHFFFAOYSA-N
XLogP1.46
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpropan-2-ylcarbamoyl)acetamide?
The IUPAC name of N-(1-phenylpropan-2-ylcarbamoyl)acetamide (CID 3745242) is N-(1-phenylpropan-2-ylcarbamoyl)acetamide.
What is the SMILES notation for N-(1-phenylpropan-2-ylcarbamoyl)acetamide?
The canonical SMILES for N-(1-phenylpropan-2-ylcarbamoyl)acetamide is CC(=O)NC(=O)NC(C)Cc1ccccc1.
What is the InChIKey of N-(1-phenylpropan-2-ylcarbamoyl)acetamide?
The InChIKey is USQGOFZXYLOQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-9(13-12(16)14-10(2)15)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H2,13,14,15,16).
What are the key properties of N-(1-phenylpropan-2-ylcarbamoyl)acetamide?
N-(1-phenylpropan-2-ylcarbamoyl)acetamide has a molecular weight of 220.27 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpropan-2-ylcarbamoyl)acetamide is sourced from PubChem (CID 3745242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).