1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride

C15H23Cl2NO2 — CID 2770337

IUPAC1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride
SMILESCl.OC(COCc1ccc(Cl)cc1)CN1CCCCC1
InChIInChI=1S/C15H22ClNO2.ClH/c16-14-6-4-13(5-7-14)11-19-12-15(18)10-17-8-2-1-3-9-17;/h4-7,15,18H,1-3,8-12H2;1H
InChIKeyVCIQMVZHMOSKHJ-UHFFFAOYSA-N
MW320.26 g/mol
LogP3.13
Rot. Bonds6

About 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride

1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride (PubChem CID 2770337) has the molecular formula C15H23Cl2NO2 and a molecular weight of 320.26 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride
PubChem CID2770337
Molecular FormulaC15H23Cl2NO2
Molecular Weight320.26 g/mol
Exact Mass319.11
IUPAC Name1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride
SMILESCl.OC(COCc1ccc(Cl)cc1)CN1CCCCC1
InChIInChI=1S/C15H22ClNO2.ClH/c16-14-6-4-13(5-7-14)11-19-12-15(18)10-17-8-2-1-3-9-17;/h4-7,15,18H,1-3,8-12H2;1H
InChIKeyVCIQMVZHMOSKHJ-UHFFFAOYSA-N
XLogP3.13
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.26
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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1-[3-[(2-Chlorophenyl)methoxy]-2-hydroxypropyl]piperidine-4-carboxamide
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1-[1-(4-Chlorophenyl)ethoxy]-3-[2-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol
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1-(Benzylamino)-3-[(4-chlorophenyl)methoxy]propan-2-ol;hydrochloride
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1-(Benzyloxy)-3-(2,6-dimethyl-1-piperidinyl)-2-propanol hydrochloride
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1-(3,5-Dimethylpiperidin-1-yl)-3-[(2-fluorophenyl)methoxy]propan-2-ol;hydrochloride
CID 16237309
1-(2-Methylpiperidin-1-yl)-3-phenylmethoxypropan-2-ol;hydrochloride
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CID 16807026
CID 16807026
4-[Bis(4-chlorophenyl)methoxy]-1-methylpiperidine
CID 24874575

Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride?
The IUPAC name of 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride (CID 2770337) is 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride.
What is the SMILES notation for 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride?
The canonical SMILES for 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride is Cl.OC(COCc1ccc(Cl)cc1)CN1CCCCC1.
What is the InChIKey of 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride?
The InChIKey is VCIQMVZHMOSKHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2.ClH/c16-14-6-4-13(5-7-14)11-19-12-15(18)10-17-8-2-1-3-9-17;/h4-7,15,18H,1-3,8-12H2;1H.
What are the key properties of 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride?
1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride has a molecular weight of 320.26 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol;hydrochloride is sourced from PubChem (CID 2770337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).