1-piperidin-3-ylhexan-2-ol

C11H23NO — CID 67829619

IUPAC1-piperidin-3-ylhexan-2-ol
SMILESCCCCC(O)CC1CCCNC1
InChIInChI=1S/C11H23NO/c1-2-3-6-11(13)8-10-5-4-7-12-9-10/h10-13H,2-9H2,1H3
InChIKeyZUXRIYBQKWBTFW-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.93
Rot. Bonds5

About 1-piperidin-3-ylhexan-2-ol

1-piperidin-3-ylhexan-2-ol (PubChem CID 67829619) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-piperidin-3-ylhexan-2-ol.

Molecular Properties

Compound Name1-piperidin-3-ylhexan-2-ol
PubChem CID67829619
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-piperidin-3-ylhexan-2-ol
SMILESCCCCC(O)CC1CCCNC1
InChIInChI=1S/C11H23NO/c1-2-3-6-11(13)8-10-5-4-7-12-9-10/h10-13H,2-9H2,1H3
InChIKeyZUXRIYBQKWBTFW-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-ylhexan-2-ol?
The IUPAC name of 1-piperidin-3-ylhexan-2-ol (CID 67829619) is 1-piperidin-3-ylhexan-2-ol.
What is the SMILES notation for 1-piperidin-3-ylhexan-2-ol?
The canonical SMILES for 1-piperidin-3-ylhexan-2-ol is CCCCC(O)CC1CCCNC1.
What is the InChIKey of 1-piperidin-3-ylhexan-2-ol?
The InChIKey is ZUXRIYBQKWBTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-2-3-6-11(13)8-10-5-4-7-12-9-10/h10-13H,2-9H2,1H3.
What are the key properties of 1-piperidin-3-ylhexan-2-ol?
1-piperidin-3-ylhexan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-ylhexan-2-ol is sourced from PubChem (CID 67829619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).