N-(2-benzylphenyl)-2,2-dimethylpropanamide

C18H21NO — CID 736045

IUPACN-(2-benzylphenyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C18H21NO/c1-18(2,3)17(20)19-16-12-8-7-11-15(16)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyBDYMLDYIYIGVCY-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.26
Rot. Bonds3

About N-(2-benzylphenyl)-2,2-dimethylpropanamide

N-(2-benzylphenyl)-2,2-dimethylpropanamide (PubChem CID 736045) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(2-benzylphenyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-benzylphenyl)-2,2-dimethylpropanamide
PubChem CID736045
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(2-benzylphenyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1ccccc1Cc1ccccc1
InChIInChI=1S/C18H21NO/c1-18(2,3)17(20)19-16-12-8-7-11-15(16)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20)
InChIKeyBDYMLDYIYIGVCY-UHFFFAOYSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-benzylphenyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-benzylphenyl)-2,2-dimethylpropanamide (CID 736045) is N-(2-benzylphenyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-benzylphenyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-benzylphenyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1ccccc1Cc1ccccc1.
What is the InChIKey of N-(2-benzylphenyl)-2,2-dimethylpropanamide?
The InChIKey is BDYMLDYIYIGVCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-18(2,3)17(20)19-16-12-8-7-11-15(16)13-14-9-5-4-6-10-14/h4-12H,13H2,1-3H3,(H,19,20).
What are the key properties of N-(2-benzylphenyl)-2,2-dimethylpropanamide?
N-(2-benzylphenyl)-2,2-dimethylpropanamide has a molecular weight of 267.37 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylphenyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 736045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).