2-methyl-2-(2-phenylphenyl)propanenitrile

C16H15N — CID 151853688

IUPAC2-methyl-2-(2-phenylphenyl)propanenitrile
SMILESCC(C)(C#N)c1ccccc1-c1ccccc1
InChIInChI=1S/C16H15N/c1-16(2,12-17)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKeySJFUHZIHGDECSC-UHFFFAOYSA-N
MW221.30 g/mol
LogP4.15
Rot. Bonds2

About 2-methyl-2-(2-phenylphenyl)propanenitrile

2-methyl-2-(2-phenylphenyl)propanenitrile (PubChem CID 151853688) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-methyl-2-(2-phenylphenyl)propanenitrile.

Molecular Properties

Compound Name2-methyl-2-(2-phenylphenyl)propanenitrile
PubChem CID151853688
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC Name2-methyl-2-(2-phenylphenyl)propanenitrile
SMILESCC(C)(C#N)c1ccccc1-c1ccccc1
InChIInChI=1S/C16H15N/c1-16(2,12-17)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11H,1-2H3
InChIKeySJFUHZIHGDECSC-UHFFFAOYSA-N
XLogP4.15
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-phenylphenyl)propanenitrile?
The IUPAC name of 2-methyl-2-(2-phenylphenyl)propanenitrile (CID 151853688) is 2-methyl-2-(2-phenylphenyl)propanenitrile.
What is the SMILES notation for 2-methyl-2-(2-phenylphenyl)propanenitrile?
The canonical SMILES for 2-methyl-2-(2-phenylphenyl)propanenitrile is CC(C)(C#N)c1ccccc1-c1ccccc1.
What is the InChIKey of 2-methyl-2-(2-phenylphenyl)propanenitrile?
The InChIKey is SJFUHZIHGDECSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N/c1-16(2,12-17)15-11-7-6-10-14(15)13-8-4-3-5-9-13/h3-11H,1-2H3.
What are the key properties of 2-methyl-2-(2-phenylphenyl)propanenitrile?
2-methyl-2-(2-phenylphenyl)propanenitrile has a molecular weight of 221.30 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-phenylphenyl)propanenitrile is sourced from PubChem (CID 151853688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).