3-butyl-6-propan-2-yl-2-propylpyridine

C15H25N — CID 138530868

IUPAC3-butyl-6-propan-2-yl-2-propylpyridine
SMILESCCCCc1ccc(C(C)C)nc1CCC
InChIInChI=1S/C15H25N/c1-5-7-9-13-10-11-14(12(3)4)16-15(13)8-6-2/h10-12H,5-9H2,1-4H3
InChIKeyOEVFDYLENMRZNR-UHFFFAOYSA-N
MW219.37 g/mol
LogP4.50
Rot. Bonds6

About 3-butyl-6-propan-2-yl-2-propylpyridine

3-butyl-6-propan-2-yl-2-propylpyridine (PubChem CID 138530868) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 3-butyl-6-propan-2-yl-2-propylpyridine.

Molecular Properties

Compound Name3-butyl-6-propan-2-yl-2-propylpyridine
PubChem CID138530868
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name3-butyl-6-propan-2-yl-2-propylpyridine
SMILESCCCCc1ccc(C(C)C)nc1CCC
InChIInChI=1S/C15H25N/c1-5-7-9-13-10-11-14(12(3)4)16-15(13)8-6-2/h10-12H,5-9H2,1-4H3
InChIKeyOEVFDYLENMRZNR-UHFFFAOYSA-N
XLogP4.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-butyl-6-propan-2-yl-2-propylpyridine?
The IUPAC name of 3-butyl-6-propan-2-yl-2-propylpyridine (CID 138530868) is 3-butyl-6-propan-2-yl-2-propylpyridine.
What is the SMILES notation for 3-butyl-6-propan-2-yl-2-propylpyridine?
The canonical SMILES for 3-butyl-6-propan-2-yl-2-propylpyridine is CCCCc1ccc(C(C)C)nc1CCC.
What is the InChIKey of 3-butyl-6-propan-2-yl-2-propylpyridine?
The InChIKey is OEVFDYLENMRZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c1-5-7-9-13-10-11-14(12(3)4)16-15(13)8-6-2/h10-12H,5-9H2,1-4H3.
What are the key properties of 3-butyl-6-propan-2-yl-2-propylpyridine?
3-butyl-6-propan-2-yl-2-propylpyridine has a molecular weight of 219.37 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-6-propan-2-yl-2-propylpyridine is sourced from PubChem (CID 138530868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).