3-(4-fluorophenyl)pyrrolidine

C10H12FN — CID 3159729

IUPAC3-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc(C2CCNC2)cc1
InChIInChI=1S/C10H12FN/c11-10-3-1-8(2-4-10)9-5-6-12-7-9/h1-4,9,12H,5-7H2
InChIKeyIWOQWISAVOSATC-UHFFFAOYSA-N
MW165.21 g/mol
LogP1.90
Rot. Bonds1

About 3-(4-fluorophenyl)pyrrolidine

3-(4-fluorophenyl)pyrrolidine (PubChem CID 3159729) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is 3-(4-fluorophenyl)pyrrolidine.

Molecular Properties

Compound Name3-(4-fluorophenyl)pyrrolidine
PubChem CID3159729
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name3-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc(C2CCNC2)cc1
InChIInChI=1S/C10H12FN/c11-10-3-1-8(2-4-10)9-5-6-12-7-9/h1-4,9,12H,5-7H2
InChIKeyIWOQWISAVOSATC-UHFFFAOYSA-N
XLogP1.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-Methylbenzeneethanamine
CID 11503
Bicifadine
CID 47953
4-Benzylpiperidine
CID 31738
2-Phenylpropylamine
CID 11398
Phenpromethamine
CID 22276
1,2,3,6-Tetrahydro-4-phenylpyridine
CID 82553
2-(2-Fluorophenyl)ethylamine
CID 643357
3-Phenylpyrrolidine
CID 3146743
4-(4-Fluoro-benzyl)-piperidine
CID 3699841
(R)-(+)-beta-Methylphenethylamine
CID 1547949
4-(4-Fluorophenyl)-1,2,3,6-tetrahydropyridine hydrochloride
CID 197747
Phenpromethamine hydrochloride
CID 22275

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)pyrrolidine?
The IUPAC name of 3-(4-fluorophenyl)pyrrolidine (CID 3159729) is 3-(4-fluorophenyl)pyrrolidine.
What is the SMILES notation for 3-(4-fluorophenyl)pyrrolidine?
The canonical SMILES for 3-(4-fluorophenyl)pyrrolidine is Fc1ccc(C2CCNC2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)pyrrolidine?
The InChIKey is IWOQWISAVOSATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN/c11-10-3-1-8(2-4-10)9-5-6-12-7-9/h1-4,9,12H,5-7H2.
What are the key properties of 3-(4-fluorophenyl)pyrrolidine?
3-(4-fluorophenyl)pyrrolidine has a molecular weight of 165.21 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)pyrrolidine is sourced from PubChem (CID 3159729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).