2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine

C15H14BrClN2 — CID 100951353

IUPAC2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine
SMILESClc1cccc(N2CCNC2c2cccc(Br)c2)c1
InChIInChI=1S/C15H14BrClN2/c16-12-4-1-3-11(9-12)15-18-7-8-19(15)14-6-2-5-13(17)10-14/h1-6,9-10,15,18H,7-8H2
InChIKeyFRPKXVNPSNJOQJ-UHFFFAOYSA-N
MW337.65 g/mol
LogP4.21
Rot. Bonds2

About 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine

2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine (PubChem CID 100951353) has the molecular formula C15H14BrClN2 and a molecular weight of 337.65 g/mol. Its IUPAC name is 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine.

Molecular Properties

Compound Name2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine
PubChem CID100951353
Molecular FormulaC15H14BrClN2
Molecular Weight337.65 g/mol
Exact Mass336.00
IUPAC Name2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine
SMILESClc1cccc(N2CCNC2c2cccc(Br)c2)c1
InChIInChI=1S/C15H14BrClN2/c16-12-4-1-3-11(9-12)15-18-7-8-19(15)14-6-2-5-13(17)10-14/h1-6,9-10,15,18H,7-8H2
InChIKeyFRPKXVNPSNJOQJ-UHFFFAOYSA-N
XLogP4.21
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.65
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine?
The IUPAC name of 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine (CID 100951353) is 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine.
What is the SMILES notation for 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine?
The canonical SMILES for 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine is Clc1cccc(N2CCNC2c2cccc(Br)c2)c1.
What is the InChIKey of 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine?
The InChIKey is FRPKXVNPSNJOQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2/c16-12-4-1-3-11(9-12)15-18-7-8-19(15)14-6-2-5-13(17)10-14/h1-6,9-10,15,18H,7-8H2.
What are the key properties of 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine?
2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine has a molecular weight of 337.65 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromophenyl)-1-(3-chlorophenyl)imidazolidine is sourced from PubChem (CID 100951353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).