2-(5-chloro-2-phenylphenyl)-N-methylacetamide

C15H14ClNO — CID 58434018

IUPAC2-(5-chloro-2-phenylphenyl)-N-methylacetamide
SMILESCNC(=O)Cc1cc(Cl)ccc1-c1ccccc1
InChIInChI=1S/C15H14ClNO/c1-17-15(18)10-12-9-13(16)7-8-14(12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJGUCRODLWWLIKT-UHFFFAOYSA-N
MW259.74 g/mol
LogP3.30
Rot. Bonds3

About 2-(5-chloro-2-phenylphenyl)-N-methylacetamide

2-(5-chloro-2-phenylphenyl)-N-methylacetamide (PubChem CID 58434018) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is 2-(5-chloro-2-phenylphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(5-chloro-2-phenylphenyl)-N-methylacetamide
PubChem CID58434018
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name2-(5-chloro-2-phenylphenyl)-N-methylacetamide
SMILESCNC(=O)Cc1cc(Cl)ccc1-c1ccccc1
InChIInChI=1S/C15H14ClNO/c1-17-15(18)10-12-9-13(16)7-8-14(12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18)
InChIKeyJGUCRODLWWLIKT-UHFFFAOYSA-N
XLogP3.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-phenylphenyl)-N-methylacetamide?
The IUPAC name of 2-(5-chloro-2-phenylphenyl)-N-methylacetamide (CID 58434018) is 2-(5-chloro-2-phenylphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(5-chloro-2-phenylphenyl)-N-methylacetamide?
The canonical SMILES for 2-(5-chloro-2-phenylphenyl)-N-methylacetamide is CNC(=O)Cc1cc(Cl)ccc1-c1ccccc1.
What is the InChIKey of 2-(5-chloro-2-phenylphenyl)-N-methylacetamide?
The InChIKey is JGUCRODLWWLIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO/c1-17-15(18)10-12-9-13(16)7-8-14(12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of 2-(5-chloro-2-phenylphenyl)-N-methylacetamide?
2-(5-chloro-2-phenylphenyl)-N-methylacetamide has a molecular weight of 259.74 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-phenylphenyl)-N-methylacetamide is sourced from PubChem (CID 58434018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).