1-[3-[2-(methylamino)phenyl]phenyl]ethanone

C15H15NO — CID 59454304

IUPAC1-[3-[2-(methylamino)phenyl]phenyl]ethanone
SMILESCNc1ccccc1-c1cccc(C(C)=O)c1
InChIInChI=1S/C15H15NO/c1-11(17)12-6-5-7-13(10-12)14-8-3-4-9-15(14)16-2/h3-10,16H,1-2H3
InChIKeySZWSNSCHJFSROF-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.60
Rot. Bonds3

About 1-[3-[2-(methylamino)phenyl]phenyl]ethanone

1-[3-[2-(methylamino)phenyl]phenyl]ethanone (PubChem CID 59454304) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-[3-[2-(methylamino)phenyl]phenyl]ethanone.

Molecular Properties

Compound Name1-[3-[2-(methylamino)phenyl]phenyl]ethanone
PubChem CID59454304
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name1-[3-[2-(methylamino)phenyl]phenyl]ethanone
SMILESCNc1ccccc1-c1cccc(C(C)=O)c1
InChIInChI=1S/C15H15NO/c1-11(17)12-6-5-7-13(10-12)14-8-3-4-9-15(14)16-2/h3-10,16H,1-2H3
InChIKeySZWSNSCHJFSROF-UHFFFAOYSA-N
XLogP3.60
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(methylamino)phenyl]phenyl]ethanone?
The IUPAC name of 1-[3-[2-(methylamino)phenyl]phenyl]ethanone (CID 59454304) is 1-[3-[2-(methylamino)phenyl]phenyl]ethanone.
What is the SMILES notation for 1-[3-[2-(methylamino)phenyl]phenyl]ethanone?
The canonical SMILES for 1-[3-[2-(methylamino)phenyl]phenyl]ethanone is CNc1ccccc1-c1cccc(C(C)=O)c1.
What is the InChIKey of 1-[3-[2-(methylamino)phenyl]phenyl]ethanone?
The InChIKey is SZWSNSCHJFSROF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-11(17)12-6-5-7-13(10-12)14-8-3-4-9-15(14)16-2/h3-10,16H,1-2H3.
What are the key properties of 1-[3-[2-(methylamino)phenyl]phenyl]ethanone?
1-[3-[2-(methylamino)phenyl]phenyl]ethanone has a molecular weight of 225.29 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(methylamino)phenyl]phenyl]ethanone is sourced from PubChem (CID 59454304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).