1-pentan-2-ylpiperidin-3-ol

C10H21NO — CID 103723460

IUPAC1-pentan-2-ylpiperidin-3-ol
SMILESCCCC(C)N1CCCC(O)C1
InChIInChI=1S/C10H21NO/c1-3-5-9(2)11-7-4-6-10(12)8-11/h9-10,12H,3-8H2,1-2H3
InChIKeyBPAAUXWMUDCLFQ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.63
Rot. Bonds3

About 1-pentan-2-ylpiperidin-3-ol

1-pentan-2-ylpiperidin-3-ol (PubChem CID 103723460) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-pentan-2-ylpiperidin-3-ol.

Molecular Properties

Compound Name1-pentan-2-ylpiperidin-3-ol
PubChem CID103723460
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-pentan-2-ylpiperidin-3-ol
SMILESCCCC(C)N1CCCC(O)C1
InChIInChI=1S/C10H21NO/c1-3-5-9(2)11-7-4-6-10(12)8-11/h9-10,12H,3-8H2,1-2H3
InChIKeyBPAAUXWMUDCLFQ-UHFFFAOYSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-pentan-2-ylpiperidin-3-ol?
The IUPAC name of 1-pentan-2-ylpiperidin-3-ol (CID 103723460) is 1-pentan-2-ylpiperidin-3-ol.
What is the SMILES notation for 1-pentan-2-ylpiperidin-3-ol?
The canonical SMILES for 1-pentan-2-ylpiperidin-3-ol is CCCC(C)N1CCCC(O)C1.
What is the InChIKey of 1-pentan-2-ylpiperidin-3-ol?
The InChIKey is BPAAUXWMUDCLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-5-9(2)11-7-4-6-10(12)8-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 1-pentan-2-ylpiperidin-3-ol?
1-pentan-2-ylpiperidin-3-ol has a molecular weight of 171.28 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentan-2-ylpiperidin-3-ol is sourced from PubChem (CID 103723460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).