1,4-dibutylpiperidin-4-ol

C13H27NO — CID 3030741

IUPAC1,4-dibutylpiperidin-4-ol
SMILESCCCCN1CCC(O)(CCCC)CC1
InChIInChI=1S/C13H27NO/c1-3-5-7-13(15)8-11-14(12-9-13)10-6-4-2/h15H,3-12H2,1-2H3
InChIKeyTYUVRRNSIUZROH-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.80
Rot. Bonds6

About 1,4-dibutylpiperidin-4-ol

1,4-dibutylpiperidin-4-ol (PubChem CID 3030741) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 1,4-dibutylpiperidin-4-ol.

Molecular Properties

Compound Name1,4-dibutylpiperidin-4-ol
PubChem CID3030741
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name1,4-dibutylpiperidin-4-ol
SMILESCCCCN1CCC(O)(CCCC)CC1
InChIInChI=1S/C13H27NO/c1-3-5-7-13(15)8-11-14(12-9-13)10-6-4-2/h15H,3-12H2,1-2H3
InChIKeyTYUVRRNSIUZROH-UHFFFAOYSA-N
XLogP2.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dibutylpiperidin-4-ol?
The IUPAC name of 1,4-dibutylpiperidin-4-ol (CID 3030741) is 1,4-dibutylpiperidin-4-ol.
What is the SMILES notation for 1,4-dibutylpiperidin-4-ol?
The canonical SMILES for 1,4-dibutylpiperidin-4-ol is CCCCN1CCC(O)(CCCC)CC1.
What is the InChIKey of 1,4-dibutylpiperidin-4-ol?
The InChIKey is TYUVRRNSIUZROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-3-5-7-13(15)8-11-14(12-9-13)10-6-4-2/h15H,3-12H2,1-2H3.
What are the key properties of 1,4-dibutylpiperidin-4-ol?
1,4-dibutylpiperidin-4-ol has a molecular weight of 213.36 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dibutylpiperidin-4-ol is sourced from PubChem (CID 3030741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).