4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride

C11H16Cl2N2O — CID 45262580

IUPAC4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride
SMILESCN1CCC(O)(c2ccc(Cl)nc2)CC1.Cl
InChIInChI=1S/C11H15ClN2O.ClH/c1-14-6-4-11(15,5-7-14)9-2-3-10(12)13-8-9;/h2-3,8,15H,4-7H2,1H3;1H
InChIKeyIUAHVOVIQXGDIB-UHFFFAOYSA-N
MW263.17 g/mol
LogP2.07
Rot. Bonds1

About 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride

4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride (PubChem CID 45262580) has the molecular formula C11H16Cl2N2O and a molecular weight of 263.17 g/mol. Its IUPAC name is 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride.

Molecular Properties

Compound Name4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride
PubChem CID45262580
Molecular FormulaC11H16Cl2N2O
Molecular Weight263.17 g/mol
Exact Mass262.06
IUPAC Name4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride
SMILESCN1CCC(O)(c2ccc(Cl)nc2)CC1.Cl
InChIInChI=1S/C11H15ClN2O.ClH/c1-14-6-4-11(15,5-7-14)9-2-3-10(12)13-8-9;/h2-3,8,15H,4-7H2,1H3;1H
InChIKeyIUAHVOVIQXGDIB-UHFFFAOYSA-N
XLogP2.07
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.17
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride?
The IUPAC name of 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride (CID 45262580) is 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride.
What is the SMILES notation for 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride?
The canonical SMILES for 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride is CN1CCC(O)(c2ccc(Cl)nc2)CC1.Cl.
What is the InChIKey of 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride?
The InChIKey is IUAHVOVIQXGDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O.ClH/c1-14-6-4-11(15,5-7-14)9-2-3-10(12)13-8-9;/h2-3,8,15H,4-7H2,1H3;1H.
What are the key properties of 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride?
4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride has a molecular weight of 263.17 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-3-pyridinyl)-1-methylpiperidin-4-ol;hydrochloride is sourced from PubChem (CID 45262580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).