4-(2,2-dimethylpropyl)-2-pentylpyridine

C15H25N — CID 129191478

IUPAC4-(2,2-dimethylpropyl)-2-pentylpyridine
SMILESCCCCCc1cc(CC(C)(C)C)ccn1
InChIInChI=1S/C15H25N/c1-5-6-7-8-14-11-13(9-10-16-14)12-15(2,3)4/h9-11H,5-8,12H2,1-4H3
InChIKeySVWVWSNGPUZASN-UHFFFAOYSA-N
MW219.37 g/mol
LogP4.40
Rot. Bonds5

About 4-(2,2-dimethylpropyl)-2-pentylpyridine

4-(2,2-dimethylpropyl)-2-pentylpyridine (PubChem CID 129191478) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 4-(2,2-dimethylpropyl)-2-pentylpyridine.

Molecular Properties

Compound Name4-(2,2-dimethylpropyl)-2-pentylpyridine
PubChem CID129191478
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name4-(2,2-dimethylpropyl)-2-pentylpyridine
SMILESCCCCCc1cc(CC(C)(C)C)ccn1
InChIInChI=1S/C15H25N/c1-5-6-7-8-14-11-13(9-10-16-14)12-15(2,3)4/h9-11H,5-8,12H2,1-4H3
InChIKeySVWVWSNGPUZASN-UHFFFAOYSA-N
XLogP4.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-decyl-4-ethylpyridine;tetradecane
CID 174509045
4-tert-butyl-2-pentylpyridine
CID 129189676
4-chloro-2-heptylpyridine
CID 166820805
(4-octyl-2-pyridinyl)methanol
CID 156538031
2-bromo-4-(2,2-dimethylpropyl)pyridine
CID 89410737
2-propyl-4-[2-(2-propyl-4-pyridinyl)ethyl]pyridine
CID 139918723
2-tetradecylpyridine-4-carbonyl chloride
CID 154124340
4-nonadecyl-2-(4-nonadecyl-2-pyridinyl)pyridine
CID 12503697
4-tridecyl-2-(4-tridecyl-2-pyridinyl)pyridine
CID 15313372
2-(4-decyl-2-pyridinyl)-4-octylpyridine
CID 102418537
4-dodecyl-2-(4-dodecyl-2-pyridinyl)pyridine
CID 11283283
4-(4-chlorophenyl)-2-pentylpyridine
CID 146458832

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylpropyl)-2-pentylpyridine?
The IUPAC name of 4-(2,2-dimethylpropyl)-2-pentylpyridine (CID 129191478) is 4-(2,2-dimethylpropyl)-2-pentylpyridine.
What is the SMILES notation for 4-(2,2-dimethylpropyl)-2-pentylpyridine?
The canonical SMILES for 4-(2,2-dimethylpropyl)-2-pentylpyridine is CCCCCc1cc(CC(C)(C)C)ccn1.
What is the InChIKey of 4-(2,2-dimethylpropyl)-2-pentylpyridine?
The InChIKey is SVWVWSNGPUZASN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-5-6-7-8-14-11-13(9-10-16-14)12-15(2,3)4/h9-11H,5-8,12H2,1-4H3.
What are the key properties of 4-(2,2-dimethylpropyl)-2-pentylpyridine?
4-(2,2-dimethylpropyl)-2-pentylpyridine has a molecular weight of 219.37 g/mol, XLogP of 4.40, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylpropyl)-2-pentylpyridine is sourced from PubChem (CID 129191478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).