1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine

C10H10BrClFN — CID 84714851

IUPAC1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine
SMILESFc1cc(Cl)c(N2CCCC2)c(Br)c1
InChIInChI=1S/C10H10BrClFN/c11-8-5-7(13)6-9(12)10(8)14-3-1-2-4-14/h5-6H,1-4H2
InChIKeySYFARKSIHJFNFP-UHFFFAOYSA-N
MW278.55 g/mol
LogP3.84
Rot. Bonds1

About 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine

1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine (PubChem CID 84714851) has the molecular formula C10H10BrClFN and a molecular weight of 278.55 g/mol. Its IUPAC name is 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine
PubChem CID84714851
Molecular FormulaC10H10BrClFN
Molecular Weight278.55 g/mol
Exact Mass276.97
IUPAC Name1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine
SMILESFc1cc(Cl)c(N2CCCC2)c(Br)c1
InChIInChI=1S/C10H10BrClFN/c11-8-5-7(13)6-9(12)10(8)14-3-1-2-4-14/h5-6H,1-4H2
InChIKeySYFARKSIHJFNFP-UHFFFAOYSA-N
XLogP3.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.55
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-6-chloro-4-fluorophenyl)-3-tert-butyl-1,4-diazepane
CID 107617304
1-(6-bromo-2,3,4-trifluorophenyl)pyrrolidine
CID 168512097
3-bromo-5-fluoro-4-pyrrolidin-1-ylaniline
CID 84709742
3-bromo-5-fluoro-4-piperidin-1-ylaniline
CID 84713585
8-(2-bromo-6-chloro-4-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-one
CID 107617021
1-(2,4-dibromo-6-chloro-3-methoxyphenyl)pyrrolidine
CID 168512911
1-(4-chloro-2,6-difluorophenyl)pyrrolidine
CID 168512042
1-(2,6-dichloro-4-methylphenyl)pyrrolidine
CID 118374334
4-(2-bromo-4,6-difluorophenyl)morpholine
CID 84714714
5-bromo-3-chloro-2-piperidin-1-ylaniline
CID 50879529
1-(2-chloro-4-fluorophenyl)piperidine
CID 174904360
1-(2-bromo-6-chloro-4-fluorophenyl)-3-(cyclopropylamino)piperidin-2-one
CID 107617205

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine?
The IUPAC name of 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine (CID 84714851) is 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine.
What is the SMILES notation for 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine?
The canonical SMILES for 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine is Fc1cc(Cl)c(N2CCCC2)c(Br)c1.
What is the InChIKey of 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine?
The InChIKey is SYFARKSIHJFNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrClFN/c11-8-5-7(13)6-9(12)10(8)14-3-1-2-4-14/h5-6H,1-4H2.
What are the key properties of 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine?
1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine has a molecular weight of 278.55 g/mol, XLogP of 3.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-6-chloro-4-fluorophenyl)pyrrolidine is sourced from PubChem (CID 84714851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).