2,2-dimethylpropane;5-methyl-2-phenylpyridine

C17H23N — CID 143955006

IUPAC2,2-dimethylpropane;5-methyl-2-phenylpyridine
SMILESCC(C)(C)C.Cc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C12H11N.C5H12/c1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;1-5(2,3)4/h2-9H,1H3;1-4H3
InChIKeyLXWFUIYOZRMDHA-UHFFFAOYSA-N
MW241.38 g/mol
LogP5.11
Rot. Bonds1

About 2,2-dimethylpropane;5-methyl-2-phenylpyridine

2,2-dimethylpropane;5-methyl-2-phenylpyridine (PubChem CID 143955006) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 2,2-dimethylpropane;5-methyl-2-phenylpyridine.

Molecular Properties

Compound Name2,2-dimethylpropane;5-methyl-2-phenylpyridine
PubChem CID143955006
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name2,2-dimethylpropane;5-methyl-2-phenylpyridine
SMILESCC(C)(C)C.Cc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C12H11N.C5H12/c1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;1-5(2,3)4/h2-9H,1H3;1-4H3
InChIKeyLXWFUIYOZRMDHA-UHFFFAOYSA-N
XLogP5.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500241.38
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropane;5-methyl-2-phenylpyridine?
The IUPAC name of 2,2-dimethylpropane;5-methyl-2-phenylpyridine (CID 143955006) is 2,2-dimethylpropane;5-methyl-2-phenylpyridine.
What is the SMILES notation for 2,2-dimethylpropane;5-methyl-2-phenylpyridine?
The canonical SMILES for 2,2-dimethylpropane;5-methyl-2-phenylpyridine is CC(C)(C)C.Cc1ccc(-c2ccccc2)nc1.
What is the InChIKey of 2,2-dimethylpropane;5-methyl-2-phenylpyridine?
The InChIKey is LXWFUIYOZRMDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N.C5H12/c1-10-7-8-12(13-9-10)11-5-3-2-4-6-11;1-5(2,3)4/h2-9H,1H3;1-4H3.
What are the key properties of 2,2-dimethylpropane;5-methyl-2-phenylpyridine?
2,2-dimethylpropane;5-methyl-2-phenylpyridine has a molecular weight of 241.38 g/mol, XLogP of 5.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropane;5-methyl-2-phenylpyridine is sourced from PubChem (CID 143955006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).