2-piperidin-3-ylhexan-2-ol

C11H23NO — CID 54109509

IUPAC2-piperidin-3-ylhexan-2-ol
SMILESCCCCC(C)(O)C1CCCNC1
InChIInChI=1S/C11H23NO/c1-3-4-7-11(2,13)10-6-5-8-12-9-10/h10,12-13H,3-9H2,1-2H3
InChIKeyNGBZTKROZQTEKC-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.93
Rot. Bonds4

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

2-piperidin-3-ylhexan-2-ol (PubChem CID 54109509) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-piperidin-3-ylhexan-2-ol.

Molecular Properties

Compound Name2-piperidin-3-ylhexan-2-ol
PubChem CID54109509
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-piperidin-3-ylhexan-2-ol
SMILESCCCCC(C)(O)C1CCCNC1
InChIInChI=1S/C11H23NO/c1-3-4-7-11(2,13)10-6-5-8-12-9-10/h10,12-13H,3-9H2,1-2H3
InChIKeyNGBZTKROZQTEKC-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
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 2-piperidin-3-ylhexan-2-ol?
The IUPAC name of 2-piperidin-3-ylhexan-2-ol (CID 54109509) is 2-piperidin-3-ylhexan-2-ol.
What is the SMILES notation for 2-piperidin-3-ylhexan-2-ol?
The canonical SMILES for 2-piperidin-3-ylhexan-2-ol is CCCCC(C)(O)C1CCCNC1.
What is the InChIKey of 2-piperidin-3-ylhexan-2-ol?
The InChIKey is NGBZTKROZQTEKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-4-7-11(2,13)10-6-5-8-12-9-10/h10,12-13H,3-9H2,1-2H3.
What are the key properties of 2-piperidin-3-ylhexan-2-ol?
2-piperidin-3-ylhexan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-3-ylhexan-2-ol is sourced from PubChem (CID 54109509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).