1-[(4-fluorophenyl)methyl]pyrrolidine

C11H14FN — CID 10631195

IUPAC1-[(4-fluorophenyl)methyl]pyrrolidine
SMILESFc1ccc(CN2CCCC2)cc1
InChIInChI=1S/C11H14FN/c12-11-5-3-10(4-6-11)9-13-7-1-2-8-13/h3-6H,1-2,7-9H2
InChIKeyHRRFDYCXYAHGQN-UHFFFAOYSA-N
MW179.24 g/mol
LogP2.42
Rot. Bonds2

About 1-[(4-fluorophenyl)methyl]pyrrolidine

1-[(4-fluorophenyl)methyl]pyrrolidine (PubChem CID 10631195) has the molecular formula C11H14FN and a molecular weight of 179.24 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]pyrrolidine.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]pyrrolidine
PubChem CID10631195
Molecular FormulaC11H14FN
Molecular Weight179.24 g/mol
Exact Mass179.11
IUPAC Name1-[(4-fluorophenyl)methyl]pyrrolidine
SMILESFc1ccc(CN2CCCC2)cc1
InChIInChI=1S/C11H14FN/c12-11-5-3-10(4-6-11)9-13-7-1-2-8-13/h3-6H,1-2,7-9H2
InChIKeyHRRFDYCXYAHGQN-UHFFFAOYSA-N
XLogP2.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,4,7,10-tetrakis[(4-fluorophenyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102293981
(4-fluorophenyl)-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone
CID 24724346
1-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-1,4-diazepane
CID 87015648
1-[(4-ethylphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine
CID 881940
1-[2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]ethyl]azepane
CID 110826346
4,4-difluoro-1-[(4-fluorophenyl)methyl]piperidine
CID 58243431
4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine
CID 174420466
1-[(4-fluorophenyl)methyl]-4-methyliodanuidyl-1,4-diazepane
CID 168949910
3-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]propanenitrile
CID 51075570
1-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-2-methylpropan-2-ol
CID 110932473
(3R)-1-[(4-fluorophenyl)methyl]-3-methylpiperidine
CID 51531587
2-[(4-fluorophenyl)methyl]-2-azaspiro[5.5]undecane
CID 91111605

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]pyrrolidine?
The IUPAC name of 1-[(4-fluorophenyl)methyl]pyrrolidine (CID 10631195) is 1-[(4-fluorophenyl)methyl]pyrrolidine.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]pyrrolidine?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]pyrrolidine is Fc1ccc(CN2CCCC2)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]pyrrolidine?
The InChIKey is HRRFDYCXYAHGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN/c12-11-5-3-10(4-6-11)9-13-7-1-2-8-13/h3-6H,1-2,7-9H2.
What are the key properties of 1-[(4-fluorophenyl)methyl]pyrrolidine?
1-[(4-fluorophenyl)methyl]pyrrolidine has a molecular weight of 179.24 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]pyrrolidine is sourced from PubChem (CID 10631195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).