2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol

C15H31NO — CID 4262334

IUPAC2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol
SMILESCC(C)CC1CCCC(CC(C)C)N1CCO
InChIInChI=1S/C15H31NO/c1-12(2)10-14-6-5-7-15(11-13(3)4)16(14)8-9-17/h12-15,17H,5-11H2,1-4H3
InChIKeyVCBVSHSBEVILBE-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.29
Rot. Bonds6

About 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol

2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol (PubChem CID 4262334) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol
PubChem CID4262334
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol
SMILESCC(C)CC1CCCC(CC(C)C)N1CCO
InChIInChI=1S/C15H31NO/c1-12(2)10-14-6-5-7-15(11-13(3)4)16(14)8-9-17/h12-15,17H,5-11H2,1-4H3
InChIKeyVCBVSHSBEVILBE-UHFFFAOYSA-N
XLogP3.29
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol?
The IUPAC name of 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol (CID 4262334) is 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol?
The canonical SMILES for 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol is CC(C)CC1CCCC(CC(C)C)N1CCO.
What is the InChIKey of 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol?
The InChIKey is VCBVSHSBEVILBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-12(2)10-14-6-5-7-15(11-13(3)4)16(14)8-9-17/h12-15,17H,5-11H2,1-4H3.
What are the key properties of 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol?
2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol has a molecular weight of 241.42 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,6-bis(2-methylpropyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 4262334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).