8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile

C7H2BrClN4 — CID 155369195

IUPAC8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile
SMILESN#Cc1cn2c(Cl)ncc(Br)c2n1
InChIInChI=1S/C7H2BrClN4/c8-5-2-11-7(9)13-3-4(1-10)12-6(5)13/h2-3H
InChIKeyZQCBMJUJKIMNNW-UHFFFAOYSA-N
MW257.48 g/mol
LogP2.02
Rot. Bonds

About 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile

8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile (PubChem CID 155369195) has the molecular formula C7H2BrClN4 and a molecular weight of 257.48 g/mol. Its IUPAC name is 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile.

Molecular Properties

Compound Name8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile
PubChem CID155369195
Molecular FormulaC7H2BrClN4
Molecular Weight257.48 g/mol
Exact Mass255.92
IUPAC Name8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile
SMILESN#Cc1cn2c(Cl)ncc(Br)c2n1
InChIInChI=1S/C7H2BrClN4/c8-5-2-11-7(9)13-3-4(1-10)12-6(5)13/h2-3H
InChIKeyZQCBMJUJKIMNNW-UHFFFAOYSA-N
XLogP2.02
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.48
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile?
The IUPAC name of 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile (CID 155369195) is 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile.
What is the SMILES notation for 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile?
The canonical SMILES for 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile is N#Cc1cn2c(Cl)ncc(Br)c2n1.
What is the InChIKey of 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile?
The InChIKey is ZQCBMJUJKIMNNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2BrClN4/c8-5-2-11-7(9)13-3-4(1-10)12-6(5)13/h2-3H.
What are the key properties of 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile?
8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile has a molecular weight of 257.48 g/mol, XLogP of 2.02, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-5-chloroimidazo[1,2-c]pyrimidine-2-carbonitrile is sourced from PubChem (CID 155369195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).