5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride

C11H15ClFNO — CID 115038617

IUPAC5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride
SMILESCC1(c2ccc(F)cc2)CC(O)CN1.Cl
InChIInChI=1S/C11H14FNO.ClH/c1-11(6-10(14)7-13-11)8-2-4-9(12)5-3-8;/h2-5,10,13-14H,6-7H2,1H3;1H
InChIKeyORQJNQMTBVNUJO-UHFFFAOYSA-N
MW231.70 g/mol
LogP1.82
Rot. Bonds1

About 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride

5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride (PubChem CID 115038617) has the molecular formula C11H15ClFNO and a molecular weight of 231.70 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride.

Molecular Properties

Compound Name5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride
PubChem CID115038617
Molecular FormulaC11H15ClFNO
Molecular Weight231.70 g/mol
Exact Mass231.08
IUPAC Name5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride
SMILESCC1(c2ccc(F)cc2)CC(O)CN1.Cl
InChIInChI=1S/C11H14FNO.ClH/c1-11(6-10(14)7-13-11)8-2-4-9(12)5-3-8;/h2-5,10,13-14H,6-7H2,1H3;1H
InChIKeyORQJNQMTBVNUJO-UHFFFAOYSA-N
XLogP1.82
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.70
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-5-(4-methylphenyl)pyrrolidin-3-ol;hydrochloride
CID 115036461
5-(4-hydroxyphenyl)-5-methylpyrrolidin-3-ol
CID 115019379
2-(4-chlorophenyl)-2-methylpiperidin-4-ol
CID 83537285
cis-(1S,2R)-2-(4-fluorophenyl)-2-methylcyclopropan-1-amine
CID 94419746
4-fluoro-2-methyl-2-(3-methylphenyl)pyrrolidine;hydrochloride
CID 115037542
2-(4-fluorophenyl)-2-methylpiperidin-3-ol
CID 115026400
5-(4-fluorophenyl)-5-methylpiperazine-2,3-dione
CID 116856092
3-(4-fluorophenyl)-3-methylazetidine;hydrochloride
CID 146083001
4-fluoro-2-(3-fluorophenyl)-2-methylpiperidine
CID 115027328
2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine
CID 105058733
(1R)-6-fluoro-3,3-dimethyl-1,2-dihydroinden-1-ol
CID 79837861
2-[2-(4-fluorophenyl)-5-methyl-2-adamantyl]-1-(3-hydroxyazetidin-1-yl)ethanone
CID 59337152

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride?
The IUPAC name of 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride (CID 115038617) is 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride.
What is the SMILES notation for 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride?
The canonical SMILES for 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride is CC1(c2ccc(F)cc2)CC(O)CN1.Cl.
What is the InChIKey of 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride?
The InChIKey is ORQJNQMTBVNUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO.ClH/c1-11(6-10(14)7-13-11)8-2-4-9(12)5-3-8;/h2-5,10,13-14H,6-7H2,1H3;1H.
What are the key properties of 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride?
5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride has a molecular weight of 231.70 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-5-methylpyrrolidin-3-ol;hydrochloride is sourced from PubChem (CID 115038617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).