6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol

C17H26ClNO — CID 97355587

IUPAC6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol
SMILESOCCCCCCN1CCC(c2ccccc2Cl)CC1
InChIInChI=1S/C17H26ClNO/c18-17-8-4-3-7-16(17)15-9-12-19(13-10-15)11-5-1-2-6-14-20/h3-4,7-8,15,20H,1-2,5-6,9-14H2
InChIKeyNOWQHJDMLZWVTP-UHFFFAOYSA-N
MW295.85 g/mol
LogP4.07
Rot. Bonds7

About 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol

6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol (PubChem CID 97355587) has the molecular formula C17H26ClNO and a molecular weight of 295.85 g/mol. Its IUPAC name is 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol.

Molecular Properties

Compound Name6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol
PubChem CID97355587
Molecular FormulaC17H26ClNO
Molecular Weight295.85 g/mol
Exact Mass295.17
IUPAC Name6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol
SMILESOCCCCCCN1CCC(c2ccccc2Cl)CC1
InChIInChI=1S/C17H26ClNO/c18-17-8-4-3-7-16(17)15-9-12-19(13-10-15)11-5-1-2-6-14-20/h3-4,7-8,15,20H,1-2,5-6,9-14H2
InChIKeyNOWQHJDMLZWVTP-UHFFFAOYSA-N
XLogP4.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.85
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

5-[4-(2-chlorophenyl)piperidin-1-yl]pentan-1-ol;hydrochloride
CID 117067038
2-[4-(2-chlorophenyl)piperidin-1-yl]acetic acid
CID 82131899
1-[4-[4-(2-chlorophenyl)piperidin-1-yl]butyl]benzimidazole
CID 118386910
3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol
CID 110936045
5-[4-(2-methyl-1H-indol-3-yl)piperidin-1-yl]pentan-1-ol
CID 110923848
3-(2-chlorophenyl)-1-methylazetidine
CID 167307075
4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]butan-1-ol
CID 110931478
4-[4-(2-fluoroanilino)piperidin-1-yl]butan-1-ol
CID 111496659
4-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]butan-1-ol
CID 110931575
6-phenylhexan-1-ol;1-(6-phenylhexyl)piperidine
CID 23016534
6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
6-(4-aminopiperidin-1-yl)hexan-1-ol
CID 70276836

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol?
The IUPAC name of 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol (CID 97355587) is 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol.
What is the SMILES notation for 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol?
The canonical SMILES for 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol is OCCCCCCN1CCC(c2ccccc2Cl)CC1.
What is the InChIKey of 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol?
The InChIKey is NOWQHJDMLZWVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClNO/c18-17-8-4-3-7-16(17)15-9-12-19(13-10-15)11-5-1-2-6-14-20/h3-4,7-8,15,20H,1-2,5-6,9-14H2.
What are the key properties of 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol?
6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol has a molecular weight of 295.85 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-chlorophenyl)piperidin-1-yl]hexan-1-ol is sourced from PubChem (CID 97355587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).