1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine

C17H22FN — CID 165361706

IUPAC1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine
SMILESFc1cccc(C2(N3CCCC3)CC3CCC2C3)c1
InChIInChI=1S/C17H22FN/c18-16-5-3-4-14(11-16)17(19-8-1-2-9-19)12-13-6-7-15(17)10-13/h3-5,11,13,15H,1-2,6-10,12H2
InChIKeyMRVOPPYPUOXGRO-UHFFFAOYSA-N
MW259.37 g/mol
LogP3.94
Rot. Bonds2

About 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine

1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine (PubChem CID 165361706) has the molecular formula C17H22FN and a molecular weight of 259.37 g/mol. Its IUPAC name is 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine.

Molecular Properties

Compound Name1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine
PubChem CID165361706
Molecular FormulaC17H22FN
Molecular Weight259.37 g/mol
Exact Mass259.17
IUPAC Name1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine
SMILESFc1cccc(C2(N3CCCC3)CC3CCC2C3)c1
InChIInChI=1S/C17H22FN/c18-16-5-3-4-14(11-16)17(19-8-1-2-9-19)12-13-6-7-15(17)10-13/h3-5,11,13,15H,1-2,6-10,12H2
InChIKeyMRVOPPYPUOXGRO-UHFFFAOYSA-N
XLogP3.94
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.37
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluorophenyl)bicyclo[2.2.1]heptan-2-amine
CID 165361700
[4-(adamantane-1-carbonyl)piperazin-1-yl]-[1-(3-fluorophenyl)cyclobutyl]methanone
CID 55538682
1-(3-fluorophenyl)-2-methylcyclopropan-1-ol
CID 79333941
[2-cyclopropyl-2-(3-fluorophenyl)cyclopropyl]methanol
CID 105458990
1-(3-fluorophenyl)-3,5-dimethylcyclohexan-1-ol
CID 64735546
1-cyclobutyl-2-(3-fluorophenyl)cyclopropan-1-amine
CID 84673435
2-cyclohexyl-1-(3-fluorophenyl)cyclohexan-1-ol
CID 60794928
1-(3-fluorophenyl)-3-methylcyclopentan-1-ol
CID 64516449
1-(3-fluorophenyl)-3-(trifluoromethyl)cyclohexan-1-ol
CID 64759467
5-fluoro-5-(3-fluorophenyl)-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 115033859
(1R)-2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
CID 105432735
2-(3-fluorophenyl)-2-methylcyclopropan-1-amine
CID 62387493

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine?
The IUPAC name of 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine (CID 165361706) is 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine.
What is the SMILES notation for 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine?
The canonical SMILES for 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine is Fc1cccc(C2(N3CCCC3)CC3CCC2C3)c1.
What is the InChIKey of 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine?
The InChIKey is MRVOPPYPUOXGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22FN/c18-16-5-3-4-14(11-16)17(19-8-1-2-9-19)12-13-6-7-15(17)10-13/h3-5,11,13,15H,1-2,6-10,12H2.
What are the key properties of 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine?
1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine has a molecular weight of 259.37 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]pyrrolidine is sourced from PubChem (CID 165361706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).