2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine

C15H25N — CID 157318275

IUPAC2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine
SMILESCC(C)c1ccc(C(C)CC(C)(C)C)nc1
InChIInChI=1S/C15H25N/c1-11(2)13-7-8-14(16-10-13)12(3)9-15(4,5)6/h7-8,10-12H,9H2,1-6H3
InChIKeyFXKZCAHRNUCSAF-UHFFFAOYSA-N
MW219.37 g/mol
LogP4.74
Rot. Bonds3

About 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine

2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine (PubChem CID 157318275) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine.

Molecular Properties

Compound Name2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine
PubChem CID157318275
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine
SMILESCC(C)c1ccc(C(C)CC(C)(C)C)nc1
InChIInChI=1S/C15H25N/c1-11(2)13-7-8-14(16-10-13)12(3)9-15(4,5)6/h7-8,10-12H,9H2,1-6H3
InChIKeyFXKZCAHRNUCSAF-UHFFFAOYSA-N
XLogP4.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-di(propan-2-yl)benzene;2,5-di(propan-2-yl)pyrazine;3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);bis(2,5-di(propan-2-yl)pyrimidine);ethane
CID 158024668
1-(2,2-dimethylpropyl)-4-propan-2-ylbenzene;methane
CID 166076943
2-(2-iodopropan-2-yl)-5-propan-2-ylpyridine
CID 138506536
1-(4,4-dimethylpentan-2-yl)-4-fluorobenzene
CID 157107563
1-(1-bromo-3,5,5-trimethylhexyl)-4-propan-2-ylbenzene
CID 63443331
2-[5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl]-5-propan-2-ylpyridine
CID 90268917
S-[(4S)-4-(5-bromo-2-pyridinyl)-2-methylpentan-2-yl]thiohydroxylamine
CID 164929008
5-(4,4-dimethylpentan-2-yl)-2-[4-(1-ethoxyethyl)phenyl]pyridine
CID 171083718
2-butan-2-yl-5-(2-methylbutan-2-yl)pyridine
CID 90395896
1-(6-propan-2-yl-3-pyridinyl)ethane-1,2-diol
CID 121261456
[(4R)-4-(5-methoxy-2-pyridinyl)-2-methylpentan-2-yl]-oxosulfanium
CID 174573563
1,4-di(propan-2-yl)benzene;bis(2,5-di(propan-2-yl)pyrazine);3,6-di(propan-2-yl)pyridazine;bis(2,5-di(propan-2-yl)pyridine);bis(2,5-di(propan-2-yl)pyrimidine);bis(3,6-di(propan-2-yl)-1,2,4-triazine);methane
CID 158648639

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine?
The IUPAC name of 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine (CID 157318275) is 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine.
What is the SMILES notation for 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine?
The canonical SMILES for 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine is CC(C)c1ccc(C(C)CC(C)(C)C)nc1.
What is the InChIKey of 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine?
The InChIKey is FXKZCAHRNUCSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-11(2)13-7-8-14(16-10-13)12(3)9-15(4,5)6/h7-8,10-12H,9H2,1-6H3.
What are the key properties of 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine?
2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine has a molecular weight of 219.37 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethylpentan-2-yl)-5-propan-2-ylpyridine is sourced from PubChem (CID 157318275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).