1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine

C17H18FN — CID 159405630

IUPAC1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine
SMILESCc1ccc(C2CCCN2c2ccc(F)cc2)cc1
InChIInChI=1S/C17H18FN/c1-13-4-6-14(7-5-13)17-3-2-12-19(17)16-10-8-15(18)9-11-16/h4-11,17H,2-3,12H2,1H3
InChIKeyCTIKJTHVAAFJGK-UHFFFAOYSA-N
MW255.34 g/mol
LogP4.48
Rot. Bonds2

About 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine

1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine (PubChem CID 159405630) has the molecular formula C17H18FN and a molecular weight of 255.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine
PubChem CID159405630
Molecular FormulaC17H18FN
Molecular Weight255.34 g/mol
Exact Mass255.14
IUPAC Name1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine
SMILESCc1ccc(C2CCCN2c2ccc(F)cc2)cc1
InChIInChI=1S/C17H18FN/c1-13-4-6-14(7-5-13)17-3-2-12-19(17)16-10-8-15(18)9-11-16/h4-11,17H,2-3,12H2,1H3
InChIKeyCTIKJTHVAAFJGK-UHFFFAOYSA-N
XLogP4.48
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-3-methylimidazo[1,2-a]pyridine
CID 171799333
1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-methylpropan-1-one
CID 50747022
(2S)-1-(4-fluorophenyl)sulfonyl-2-(4-methylphenyl)pyrrolidine
CID 25498073
2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]-5-methyl-1,3,4-thiadiazole
CID 97009430
1-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-(4-methylphenyl)ethanone
CID 75841513
1,2-diphenylpyrrolidine;ethanol
CID 67627522
1,2-diphenylpyrrolidine;hydrochloride
CID 23512926
[1-(4-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]-[(2R)-2-(4-methylphenyl)pyrrolidin-1-yl]methanone
CID 39976399
2-(4-methylphenyl)-1-[2-(trifluoromethyl)oxiran-2-yl]pyrrolidine
CID 143497374
(2S)-1-(4-fluorophenyl)sulfonyl-2-(4-methylphenyl)azepane
CID 95078895
2-(4-fluorophenyl)-1-propylpyrrolidine
CID 102544448
(2R)-2-(4-methoxyphenyl)-1-phenylpyrrolidine
CID 134967090

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine?
The IUPAC name of 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine (CID 159405630) is 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine?
The canonical SMILES for 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine is Cc1ccc(C2CCCN2c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine?
The InChIKey is CTIKJTHVAAFJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN/c1-13-4-6-14(7-5-13)17-3-2-12-19(17)16-10-8-15(18)9-11-16/h4-11,17H,2-3,12H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine?
1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine has a molecular weight of 255.34 g/mol, XLogP of 4.48, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(4-methylphenyl)pyrrolidine is sourced from PubChem (CID 159405630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).