5-phenyl-2-propan-2-ylpyridine

C14H15N — CID 18340622

IUPAC5-phenyl-2-propan-2-ylpyridine
SMILESCC(C)c1ccc(-c2ccccc2)cn1
InChIInChI=1S/C14H15N/c1-11(2)14-9-8-13(10-15-14)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyCAIVWLNRRPZUAJ-UHFFFAOYSA-N
MW197.28 g/mol
LogP3.87
Rot. Bonds2

About 5-phenyl-2-propan-2-ylpyridine

5-phenyl-2-propan-2-ylpyridine (PubChem CID 18340622) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-phenyl-2-propan-2-ylpyridine.

Molecular Properties

Compound Name5-phenyl-2-propan-2-ylpyridine
PubChem CID18340622
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name5-phenyl-2-propan-2-ylpyridine
SMILESCC(C)c1ccc(-c2ccccc2)cn1
InChIInChI=1S/C14H15N/c1-11(2)14-9-8-13(10-15-14)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyCAIVWLNRRPZUAJ-UHFFFAOYSA-N
XLogP3.87
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-propan-2-ylpyridine?
The IUPAC name of 5-phenyl-2-propan-2-ylpyridine (CID 18340622) is 5-phenyl-2-propan-2-ylpyridine.
What is the SMILES notation for 5-phenyl-2-propan-2-ylpyridine?
The canonical SMILES for 5-phenyl-2-propan-2-ylpyridine is CC(C)c1ccc(-c2ccccc2)cn1.
What is the InChIKey of 5-phenyl-2-propan-2-ylpyridine?
The InChIKey is CAIVWLNRRPZUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-11(2)14-9-8-13(10-15-14)12-6-4-3-5-7-12/h3-11H,1-2H3.
What are the key properties of 5-phenyl-2-propan-2-ylpyridine?
5-phenyl-2-propan-2-ylpyridine has a molecular weight of 197.28 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-propan-2-ylpyridine is sourced from PubChem (CID 18340622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).