piperidin-3-ol;triethylborane

C11H26BNO — CID 159801081

IUPACpiperidin-3-ol;triethylborane
SMILESCCB(CC)CC.OC1CCCNC1
InChIInChI=1S/C6H15B.C5H11NO/c1-4-7(5-2)6-3;7-5-2-1-3-6-4-5/h4-6H2,1-3H3;5-7H,1-4H2
InChIKeyNJUIFAVIPBPHSS-UHFFFAOYSA-N
MW199.15 g/mol
LogP2.27
Rot. Bonds3

About piperidin-3-ol;triethylborane

piperidin-3-ol;triethylborane (PubChem CID 159801081) has the molecular formula C11H26BNO and a molecular weight of 199.15 g/mol. Its IUPAC name is piperidin-3-ol;triethylborane.

Molecular Properties

Compound Namepiperidin-3-ol;triethylborane
PubChem CID159801081
Molecular FormulaC11H26BNO
Molecular Weight199.15 g/mol
Exact Mass199.21
IUPAC Namepiperidin-3-ol;triethylborane
SMILESCCB(CC)CC.OC1CCCNC1
InChIInChI=1S/C6H15B.C5H11NO/c1-4-7(5-2)6-3;7-5-2-1-3-6-4-5/h4-6H2,1-3H3;5-7H,1-4H2
InChIKeyNJUIFAVIPBPHSS-UHFFFAOYSA-N
XLogP2.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.15
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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pyrrolidine;(3S)-pyrrolidin-3-ol
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1,5-diazocan-3-ol
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pyrrolidin-3-ol;uranium
CID 143428396
2-piperidin-3-ylbutan-2-ol
CID 63586087
2-piperidin-3-ylpentan-2-ol
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Frequently Asked Questions

What is the IUPAC name of piperidin-3-ol;triethylborane?
The IUPAC name of piperidin-3-ol;triethylborane (CID 159801081) is piperidin-3-ol;triethylborane.
What is the SMILES notation for piperidin-3-ol;triethylborane?
The canonical SMILES for piperidin-3-ol;triethylborane is CCB(CC)CC.OC1CCCNC1.
What is the InChIKey of piperidin-3-ol;triethylborane?
The InChIKey is NJUIFAVIPBPHSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15B.C5H11NO/c1-4-7(5-2)6-3;7-5-2-1-3-6-4-5/h4-6H2,1-3H3;5-7H,1-4H2.
What are the key properties of piperidin-3-ol;triethylborane?
piperidin-3-ol;triethylborane has a molecular weight of 199.15 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-ol;triethylborane is sourced from PubChem (CID 159801081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).