1-benzhydryloxypiperidine;hydrochloride

C18H22ClNO — CID 18381951

IUPAC1-benzhydryloxypiperidine;hydrochloride
SMILESCl.c1ccc(C(ON2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C18H21NO.ClH/c1-4-10-16(11-5-1)18(17-12-6-2-7-13-17)20-19-14-8-3-9-15-19;/h1-2,4-7,10-13,18H,3,8-9,14-15H2;1H
InChIKeyAWCYNVBPYBNNRA-UHFFFAOYSA-N
MW303.83 g/mol
LogP4.62
Rot. Bonds4

About 1-benzhydryloxypiperidine;hydrochloride

1-benzhydryloxypiperidine;hydrochloride (PubChem CID 18381951) has the molecular formula C18H22ClNO and a molecular weight of 303.83 g/mol. Its IUPAC name is 1-benzhydryloxypiperidine;hydrochloride.

Molecular Properties

Compound Name1-benzhydryloxypiperidine;hydrochloride
PubChem CID18381951
Molecular FormulaC18H22ClNO
Molecular Weight303.83 g/mol
Exact Mass303.14
IUPAC Name1-benzhydryloxypiperidine;hydrochloride
SMILESCl.c1ccc(C(ON2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C18H21NO.ClH/c1-4-10-16(11-5-1)18(17-12-6-2-7-13-17)20-19-14-8-3-9-15-19;/h1-2,4-7,10-13,18H,3,8-9,14-15H2;1H
InChIKeyAWCYNVBPYBNNRA-UHFFFAOYSA-N
XLogP4.62
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.83
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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[phenyl(piperidin-1-yl)methyl] formate;dihydrochloride
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methyl 2-phenyl-2-piperidin-1-ylacetate
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3-(azepan-1-yl)-4-benzhydryloxy-1,2,5-thiadiazole
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2-phenyl-2-piperidin-1-ylacetamide;hydrochloride
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1-(3-methyl-1-phenylbutyl)piperidine
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1-[(1S)-3-methyl-1-phenylbutyl]piperidine
CID 92967702
1-(2-benzhydryloxyethyl)azetidine
CID 23275348
cumene;methane;1-methylpiperidine
CID 177007302
1-(3-chloro-3-phenylpropyl)piperidine;hydrochloride
CID 67656037
phenyl-(2-pyrrolidin-1-ylphenyl)methanamine;hydrochloride
CID 135262853

Frequently Asked Questions

What is the IUPAC name of 1-benzhydryloxypiperidine;hydrochloride?
The IUPAC name of 1-benzhydryloxypiperidine;hydrochloride (CID 18381951) is 1-benzhydryloxypiperidine;hydrochloride.
What is the SMILES notation for 1-benzhydryloxypiperidine;hydrochloride?
The canonical SMILES for 1-benzhydryloxypiperidine;hydrochloride is Cl.c1ccc(C(ON2CCCCC2)c2ccccc2)cc1.
What is the InChIKey of 1-benzhydryloxypiperidine;hydrochloride?
The InChIKey is AWCYNVBPYBNNRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO.ClH/c1-4-10-16(11-5-1)18(17-12-6-2-7-13-17)20-19-14-8-3-9-15-19;/h1-2,4-7,10-13,18H,3,8-9,14-15H2;1H.
What are the key properties of 1-benzhydryloxypiperidine;hydrochloride?
1-benzhydryloxypiperidine;hydrochloride has a molecular weight of 303.83 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzhydryloxypiperidine;hydrochloride is sourced from PubChem (CID 18381951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).