1-amino-1,3-diphenylpropan-2-one

C15H15NO — CID 11458775

IUPAC1-amino-1,3-diphenylpropan-2-one
SMILESNC(C(=O)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c16-15(13-9-5-2-6-10-13)14(17)11-12-7-3-1-4-8-12/h1-10,15H,11,16H2
InChIKeyAVNHUMRHWIRPDF-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.50
Rot. Bonds4

About 1-amino-1,3-diphenylpropan-2-one

1-amino-1,3-diphenylpropan-2-one (PubChem CID 11458775) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-amino-1,3-diphenylpropan-2-one.

Molecular Properties

Compound Name1-amino-1,3-diphenylpropan-2-one
PubChem CID11458775
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name1-amino-1,3-diphenylpropan-2-one
SMILESNC(C(=O)Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO/c16-15(13-9-5-2-6-10-13)14(17)11-12-7-3-1-4-8-12/h1-10,15H,11,16H2
InChIKeyAVNHUMRHWIRPDF-UHFFFAOYSA-N
XLogP2.50
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-1,3-diphenylpropan-2-one?
The IUPAC name of 1-amino-1,3-diphenylpropan-2-one (CID 11458775) is 1-amino-1,3-diphenylpropan-2-one.
What is the SMILES notation for 1-amino-1,3-diphenylpropan-2-one?
The canonical SMILES for 1-amino-1,3-diphenylpropan-2-one is NC(C(=O)Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1-amino-1,3-diphenylpropan-2-one?
The InChIKey is AVNHUMRHWIRPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c16-15(13-9-5-2-6-10-13)14(17)11-12-7-3-1-4-8-12/h1-10,15H,11,16H2.
What are the key properties of 1-amino-1,3-diphenylpropan-2-one?
1-amino-1,3-diphenylpropan-2-one has a molecular weight of 225.29 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1,3-diphenylpropan-2-one is sourced from PubChem (CID 11458775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).