1,2-diphenylpyrrolidine;hydrochloride

C16H18ClN — CID 23512926

IUPAC1,2-diphenylpyrrolidine;hydrochloride
SMILESCl.c1ccc(C2CCCN2c2ccccc2)cc1
InChIInChI=1S/C16H17N.ClH/c1-3-8-14(9-4-1)16-12-7-13-17(16)15-10-5-2-6-11-15;/h1-6,8-11,16H,7,12-13H2;1H
InChIKeyQAZOPXKKCZHVHH-UHFFFAOYSA-N
MW259.78 g/mol
LogP4.45
Rot. Bonds2

About 1,2-diphenylpyrrolidine;hydrochloride

1,2-diphenylpyrrolidine;hydrochloride (PubChem CID 23512926) has the molecular formula C16H18ClN and a molecular weight of 259.78 g/mol. Its IUPAC name is 1,2-diphenylpyrrolidine;hydrochloride.

Molecular Properties

Compound Name1,2-diphenylpyrrolidine;hydrochloride
PubChem CID23512926
Molecular FormulaC16H18ClN
Molecular Weight259.78 g/mol
Exact Mass259.11
IUPAC Name1,2-diphenylpyrrolidine;hydrochloride
SMILESCl.c1ccc(C2CCCN2c2ccccc2)cc1
InChIInChI=1S/C16H17N.ClH/c1-3-8-14(9-4-1)16-12-7-13-17(16)15-10-5-2-6-11-15;/h1-6,8-11,16H,7,12-13H2;1H
InChIKeyQAZOPXKKCZHVHH-UHFFFAOYSA-N
XLogP4.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.78
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-methyl-4-(1-phenylpyrrolidin-2-yl)pyridine
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1-phenyl-N-(1-phenylpyrrolidin-2-yl)pyrrolidin-2-amine
CID 175548020
1-[2-amino-4-(2-phenylpyrrolidin-1-yl)phenyl]ethanone
CID 104528423
(3R)-3,4-diphenylmorpholine
CID 22860790
2-(3-cyclopropylphenyl)-1-(3-methylphenyl)pyrrolidine
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Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylpyrrolidine;hydrochloride?
The IUPAC name of 1,2-diphenylpyrrolidine;hydrochloride (CID 23512926) is 1,2-diphenylpyrrolidine;hydrochloride.
What is the SMILES notation for 1,2-diphenylpyrrolidine;hydrochloride?
The canonical SMILES for 1,2-diphenylpyrrolidine;hydrochloride is Cl.c1ccc(C2CCCN2c2ccccc2)cc1.
What is the InChIKey of 1,2-diphenylpyrrolidine;hydrochloride?
The InChIKey is QAZOPXKKCZHVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N.ClH/c1-3-8-14(9-4-1)16-12-7-13-17(16)15-10-5-2-6-11-15;/h1-6,8-11,16H,7,12-13H2;1H.
What are the key properties of 1,2-diphenylpyrrolidine;hydrochloride?
1,2-diphenylpyrrolidine;hydrochloride has a molecular weight of 259.78 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylpyrrolidine;hydrochloride is sourced from PubChem (CID 23512926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).