2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol

C19H37NO — CID 166897874

IUPAC2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol
SMILESCC(C)(C)C1CC(O)C(CC(C)(C)C2CCCCC2)CN1
InChIInChI=1S/C19H37NO/c1-18(2,3)17-11-16(21)14(13-20-17)12-19(4,5)15-9-7-6-8-10-15/h14-17,20-21H,6-13H2,1-5H3
InChIKeyMWRRIPBKFFKJTD-UHFFFAOYSA-N
MW295.51 g/mol
LogP4.37
Rot. Bonds3

About 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol

2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol (PubChem CID 166897874) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol
PubChem CID166897874
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC Name2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol
SMILESCC(C)(C)C1CC(O)C(CC(C)(C)C2CCCCC2)CN1
InChIInChI=1S/C19H37NO/c1-18(2,3)17-11-16(21)14(13-20-17)12-19(4,5)15-9-7-6-8-10-15/h14-17,20-21H,6-13H2,1-5H3
InChIKeyMWRRIPBKFFKJTD-UHFFFAOYSA-N
XLogP4.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.51
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol?
The IUPAC name of 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol (CID 166897874) is 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol?
The canonical SMILES for 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol is CC(C)(C)C1CC(O)C(CC(C)(C)C2CCCCC2)CN1.
What is the InChIKey of 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol?
The InChIKey is MWRRIPBKFFKJTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO/c1-18(2,3)17-11-16(21)14(13-20-17)12-19(4,5)15-9-7-6-8-10-15/h14-17,20-21H,6-13H2,1-5H3.
What are the key properties of 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol?
2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol has a molecular weight of 295.51 g/mol, XLogP of 4.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-(2-cyclohexyl-2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 166897874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).