2-phenyl-N-propan-2-ylbenzamide

C16H17NO — CID 976213

IUPAC2-phenyl-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C16H17NO/c1-12(2)17-16(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)
InChIKeyDLBJFXIPEFDCND-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.49
Rot. Bonds3

About 2-phenyl-N-propan-2-ylbenzamide

2-phenyl-N-propan-2-ylbenzamide (PubChem CID 976213) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-phenyl-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-phenyl-N-propan-2-ylbenzamide
PubChem CID976213
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name2-phenyl-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C16H17NO/c1-12(2)17-16(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18)
InChIKeyDLBJFXIPEFDCND-UHFFFAOYSA-N
XLogP3.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-propan-2-ylbenzamide?
The IUPAC name of 2-phenyl-N-propan-2-ylbenzamide (CID 976213) is 2-phenyl-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-phenyl-N-propan-2-ylbenzamide?
The canonical SMILES for 2-phenyl-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of 2-phenyl-N-propan-2-ylbenzamide?
The InChIKey is DLBJFXIPEFDCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-12(2)17-16(18)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-12H,1-2H3,(H,17,18).
What are the key properties of 2-phenyl-N-propan-2-ylbenzamide?
2-phenyl-N-propan-2-ylbenzamide has a molecular weight of 239.32 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-propan-2-ylbenzamide is sourced from PubChem (CID 976213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).