N-(2-bromophenyl)pyrazin-2-amine

C10H8BrN3 — CID 14689441

IUPACN-(2-bromophenyl)pyrazin-2-amine
SMILESBrc1ccccc1Nc1cnccn1
InChIInChI=1S/C10H8BrN3/c11-8-3-1-2-4-9(8)14-10-7-12-5-6-13-10/h1-7H,(H,13,14)
InChIKeyVBOMJYWQQUPPRU-UHFFFAOYSA-N
MW250.10 g/mol
LogP2.98
Rot. Bonds2

About N-(2-bromophenyl)pyrazin-2-amine

N-(2-bromophenyl)pyrazin-2-amine (PubChem CID 14689441) has the molecular formula C10H8BrN3 and a molecular weight of 250.10 g/mol. Its IUPAC name is N-(2-bromophenyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-(2-bromophenyl)pyrazin-2-amine
PubChem CID14689441
Molecular FormulaC10H8BrN3
Molecular Weight250.10 g/mol
Exact Mass248.99
IUPAC NameN-(2-bromophenyl)pyrazin-2-amine
SMILESBrc1ccccc1Nc1cnccn1
InChIInChI=1S/C10H8BrN3/c11-8-3-1-2-4-9(8)14-10-7-12-5-6-13-10/h1-7H,(H,13,14)
InChIKeyVBOMJYWQQUPPRU-UHFFFAOYSA-N
XLogP2.98
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.10
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)pyrazin-2-amine?
The IUPAC name of N-(2-bromophenyl)pyrazin-2-amine (CID 14689441) is N-(2-bromophenyl)pyrazin-2-amine.
What is the SMILES notation for N-(2-bromophenyl)pyrazin-2-amine?
The canonical SMILES for N-(2-bromophenyl)pyrazin-2-amine is Brc1ccccc1Nc1cnccn1.
What is the InChIKey of N-(2-bromophenyl)pyrazin-2-amine?
The InChIKey is VBOMJYWQQUPPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3/c11-8-3-1-2-4-9(8)14-10-7-12-5-6-13-10/h1-7H,(H,13,14).
What are the key properties of N-(2-bromophenyl)pyrazin-2-amine?
N-(2-bromophenyl)pyrazin-2-amine has a molecular weight of 250.10 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)pyrazin-2-amine is sourced from PubChem (CID 14689441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).