3-(3,5-dichlorophenyl)-3-fluoropyrrolidine

C10H10Cl2FN — CID 25143664

IUPAC3-(3,5-dichlorophenyl)-3-fluoropyrrolidine
SMILESFC1(c2cc(Cl)cc(Cl)c2)CCNC1
InChIInChI=1S/C10H10Cl2FN/c11-8-3-7(4-9(12)5-8)10(13)1-2-14-6-10/h3-5,14H,1-2,6H2
InChIKeyMTSVWPYXOZDKAU-UHFFFAOYSA-N
MW234.10 g/mol
LogP3.15
Rot. Bonds1

About 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine

3-(3,5-dichlorophenyl)-3-fluoropyrrolidine (PubChem CID 25143664) has the molecular formula C10H10Cl2FN and a molecular weight of 234.10 g/mol. Its IUPAC name is 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine.

Molecular Properties

Compound Name3-(3,5-dichlorophenyl)-3-fluoropyrrolidine
PubChem CID25143664
Molecular FormulaC10H10Cl2FN
Molecular Weight234.10 g/mol
Exact Mass233.02
IUPAC Name3-(3,5-dichlorophenyl)-3-fluoropyrrolidine
SMILESFC1(c2cc(Cl)cc(Cl)c2)CCNC1
InChIInChI=1S/C10H10Cl2FN/c11-8-3-7(4-9(12)5-8)10(13)1-2-14-6-10/h3-5,14H,1-2,6H2
InChIKeyMTSVWPYXOZDKAU-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.10
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(3-Chlorophenyl)ethyl](methyl)amine
CID 10583272
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CID 57404444
3-(3-chloro-4-fluorophenyl)-2,3,4,7-tetrahydro-1H-azepine
CID 71541195
3-(3-chlorophenyl)-2,3,4,7-tetrahydro-1H-azepine
CID 71541288
1-(3-Chloro-4-fluorophenyl)-3-azabicyclo[3.1.0]hexane
CID 16067875
3-[5-Chloro-2-(3-chlorophenyl)phenyl]pyrrolidine
CID 46206025
2-(3-Chlorophenyl)pyrrolidine
CID 4579806
2-(3,5-Dichlorophenyl)ethan-1-amine
CID 15670830
Benzenemethanamine, 3,5-dichloro-N-ethyl-
CID 457606
Benzenemethanamine, N-butyl-3,5-dichloro-
CID 457608
1-(3-Chlorophenyl)-3-azabicyclo[3.1.0]hexane Hydrochloride
CID 12719845

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine?
The IUPAC name of 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine (CID 25143664) is 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine.
What is the SMILES notation for 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine?
The canonical SMILES for 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine is FC1(c2cc(Cl)cc(Cl)c2)CCNC1.
What is the InChIKey of 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine?
The InChIKey is MTSVWPYXOZDKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2FN/c11-8-3-7(4-9(12)5-8)10(13)1-2-14-6-10/h3-5,14H,1-2,6H2.
What are the key properties of 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine?
3-(3,5-dichlorophenyl)-3-fluoropyrrolidine has a molecular weight of 234.10 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dichlorophenyl)-3-fluoropyrrolidine is sourced from PubChem (CID 25143664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).