[1-(5-chloropentyl)piperidin-2-yl]methanol

C11H22ClNO — CID 61407832

IUPAC[1-(5-chloropentyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1CCCCCCl
InChIInChI=1S/C11H22ClNO/c12-7-3-1-4-8-13-9-5-2-6-11(13)10-14/h11,14H,1-10H2
InChIKeyUHLLKNDWXBWXTL-UHFFFAOYSA-N
MW219.76 g/mol
LogP2.24
Rot. Bonds6

About [1-(5-chloropentyl)piperidin-2-yl]methanol

[1-(5-chloropentyl)piperidin-2-yl]methanol (PubChem CID 61407832) has the molecular formula C11H22ClNO and a molecular weight of 219.76 g/mol. Its IUPAC name is [1-(5-chloropentyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(5-chloropentyl)piperidin-2-yl]methanol
PubChem CID61407832
Molecular FormulaC11H22ClNO
Molecular Weight219.76 g/mol
Exact Mass219.14
IUPAC Name[1-(5-chloropentyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1CCCCCCl
InChIInChI=1S/C11H22ClNO/c12-7-3-1-4-8-13-9-5-2-6-11(13)10-14/h11,14H,1-10H2
InChIKeyUHLLKNDWXBWXTL-UHFFFAOYSA-N
XLogP2.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.76
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(5-chloropentyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(5-chloropentyl)piperidin-2-yl]methanol (CID 61407832) is [1-(5-chloropentyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(5-chloropentyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(5-chloropentyl)piperidin-2-yl]methanol is OCC1CCCCN1CCCCCCl.
What is the InChIKey of [1-(5-chloropentyl)piperidin-2-yl]methanol?
The InChIKey is UHLLKNDWXBWXTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22ClNO/c12-7-3-1-4-8-13-9-5-2-6-11(13)10-14/h11,14H,1-10H2.
What are the key properties of [1-(5-chloropentyl)piperidin-2-yl]methanol?
[1-(5-chloropentyl)piperidin-2-yl]methanol has a molecular weight of 219.76 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloropentyl)piperidin-2-yl]methanol is sourced from PubChem (CID 61407832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).