2-(3,4-dichlorophenyl)piperidin-4-ol

C11H13Cl2NO — CID 173222144

IUPAC2-(3,4-dichlorophenyl)piperidin-4-ol
SMILESOC1CCNC(c2ccc(Cl)c(Cl)c2)C1
InChIInChI=1S/C11H13Cl2NO/c12-9-2-1-7(5-10(9)13)11-6-8(15)3-4-14-11/h1-2,5,8,11,14-15H,3-4,6H2
InChIKeyRKXUQJMQVUPRFN-UHFFFAOYSA-N
MW246.14 g/mol
LogP2.78
Rot. Bonds1

About 2-(3,4-dichlorophenyl)piperidin-4-ol

2-(3,4-dichlorophenyl)piperidin-4-ol (PubChem CID 173222144) has the molecular formula C11H13Cl2NO and a molecular weight of 246.14 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)piperidin-4-ol.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)piperidin-4-ol
PubChem CID173222144
Molecular FormulaC11H13Cl2NO
Molecular Weight246.14 g/mol
Exact Mass245.04
IUPAC Name2-(3,4-dichlorophenyl)piperidin-4-ol
SMILESOC1CCNC(c2ccc(Cl)c(Cl)c2)C1
InChIInChI=1S/C11H13Cl2NO/c12-9-2-1-7(5-10(9)13)11-6-8(15)3-4-14-11/h1-2,5,8,11,14-15H,3-4,6H2
InChIKeyRKXUQJMQVUPRFN-UHFFFAOYSA-N
XLogP2.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.14
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Threo-3,4-dichlororitalinol hydrochloride
CID 16719669
(+/-)-threo-3'',4''-Dichlororitalinol methyl ether
CID 52942344
(+/-)-threo-N-Benzyl-3'',4''-dichlororitalinol
CID 52945159
2-[(3S)-3-(3,4-dichlorophenyl)piperidin-3-yl]ethanol
CID 29938807
2-[(3R)-3-(3,4-dichlorophenyl)piperidin-3-yl]ethanol
CID 68653619
2-(Benzylamino)-1-(3,4-dichlorophenyl)ethan-1-ol
CID 70463218
2-(3,4-Dichlorophenyl)-2-piperidin-4-ylethanol;hydrochloride
CID 71727754
1-Propanol, 2-(3,4-dichlorobenzylamino)-2-methyl-
CID 99360
2-[(3,4-Dichlorobenzyl)amino]-1-phenyl-1-propanol
CID 11948814
(7,8-Dichloro-1,2,3,4-tetrahydro-isoquinolin-3-yl)-methanol
CID 14027811
(2R)-2-(3,4-dichlorophenyl)-2-[(2R)-piperidin-2-yl]ethanol;hydrochloride
CID 16719763
[(1S,3S)-6,7-dichloro-1-phenyl-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
CID 168277364

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)piperidin-4-ol?
The IUPAC name of 2-(3,4-dichlorophenyl)piperidin-4-ol (CID 173222144) is 2-(3,4-dichlorophenyl)piperidin-4-ol.
What is the SMILES notation for 2-(3,4-dichlorophenyl)piperidin-4-ol?
The canonical SMILES for 2-(3,4-dichlorophenyl)piperidin-4-ol is OC1CCNC(c2ccc(Cl)c(Cl)c2)C1.
What is the InChIKey of 2-(3,4-dichlorophenyl)piperidin-4-ol?
The InChIKey is RKXUQJMQVUPRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO/c12-9-2-1-7(5-10(9)13)11-6-8(15)3-4-14-11/h1-2,5,8,11,14-15H,3-4,6H2.
What are the key properties of 2-(3,4-dichlorophenyl)piperidin-4-ol?
2-(3,4-dichlorophenyl)piperidin-4-ol has a molecular weight of 246.14 g/mol, XLogP of 2.78, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)piperidin-4-ol is sourced from PubChem (CID 173222144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).