2-(1-cyclohexylpropan-2-yl)-5-methylpyridine

C15H23N — CID 121401032

IUPAC2-(1-cyclohexylpropan-2-yl)-5-methylpyridine
SMILESCc1ccc(C(C)CC2CCCCC2)nc1
InChIInChI=1S/C15H23N/c1-12-8-9-15(16-11-12)13(2)10-14-6-4-3-5-7-14/h8-9,11,13-14H,3-7,10H2,1-2H3
InChIKeyOTBPAOLNJHIVSC-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.46
Rot. Bonds3

About 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine

2-(1-cyclohexylpropan-2-yl)-5-methylpyridine (PubChem CID 121401032) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine.

Molecular Properties

Compound Name2-(1-cyclohexylpropan-2-yl)-5-methylpyridine
PubChem CID121401032
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-(1-cyclohexylpropan-2-yl)-5-methylpyridine
SMILESCc1ccc(C(C)CC2CCCCC2)nc1
InChIInChI=1S/C15H23N/c1-12-8-9-15(16-11-12)13(2)10-14-6-4-3-5-7-14/h8-9,11,13-14H,3-7,10H2,1-2H3
InChIKeyOTBPAOLNJHIVSC-UHFFFAOYSA-N
XLogP4.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine?
The IUPAC name of 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine (CID 121401032) is 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine.
What is the SMILES notation for 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine?
The canonical SMILES for 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine is Cc1ccc(C(C)CC2CCCCC2)nc1.
What is the InChIKey of 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine?
The InChIKey is OTBPAOLNJHIVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-8-9-15(16-11-12)13(2)10-14-6-4-3-5-7-14/h8-9,11,13-14H,3-7,10H2,1-2H3.
What are the key properties of 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine?
2-(1-cyclohexylpropan-2-yl)-5-methylpyridine has a molecular weight of 217.36 g/mol, XLogP of 4.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpropan-2-yl)-5-methylpyridine is sourced from PubChem (CID 121401032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).