(2-bromophenyl)-pyrazin-2-ylmethanamine

C11H10BrN3 — CID 63970477

IUPAC(2-bromophenyl)-pyrazin-2-ylmethanamine
SMILESNC(c1cnccn1)c1ccccc1Br
InChIInChI=1S/C11H10BrN3/c12-9-4-2-1-3-8(9)11(13)10-7-14-5-6-15-10/h1-7,11H,13H2
InChIKeyBFMDXJFKVYKLIW-UHFFFAOYSA-N
MW264.13 g/mol
LogP2.29
Rot. Bonds2

About (2-bromophenyl)-pyrazin-2-ylmethanamine

(2-bromophenyl)-pyrazin-2-ylmethanamine (PubChem CID 63970477) has the molecular formula C11H10BrN3 and a molecular weight of 264.13 g/mol. Its IUPAC name is (2-bromophenyl)-pyrazin-2-ylmethanamine.

Molecular Properties

Compound Name(2-bromophenyl)-pyrazin-2-ylmethanamine
PubChem CID63970477
Molecular FormulaC11H10BrN3
Molecular Weight264.13 g/mol
Exact Mass263.01
IUPAC Name(2-bromophenyl)-pyrazin-2-ylmethanamine
SMILESNC(c1cnccn1)c1ccccc1Br
InChIInChI=1S/C11H10BrN3/c12-9-4-2-1-3-8(9)11(13)10-7-14-5-6-15-10/h1-7,11H,13H2
InChIKeyBFMDXJFKVYKLIW-UHFFFAOYSA-N
XLogP2.29
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.13
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromo-2-methylphenyl)-pyrazin-2-ylmethanamine
CID 115860529
(2-bromo-4-fluorophenyl)-pyrazin-2-ylmethanamine
CID 115860579
(2-ethoxyphenyl)-pyrazin-2-ylmethanamine
CID 62801551
(5-bromo-2-methylphenyl)-pyrazin-2-ylmethanamine
CID 115860646
(4-bromo-2-chlorophenyl)-pyrazin-2-ylmethanamine
CID 115860428
[(3-bromo-2-chlorophenyl)-pyrazin-2-ylmethyl]hydrazine
CID 105308722
1-(3-bromo-2-methylphenyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 115860344
1-(2-bromophenyl)-2-pyridin-3-yloxyethanamine
CID 117243775
(5-bromo-1H-imidazol-2-yl)-(2-bromophenyl)methanamine
CID 116835371
(R)-pyrazin-2-yl(quinolin-3-yl)methanamine
CID 93358826
(2-bromophenyl)methanediamine
CID 22286781
(2-bromophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 115374409

Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-pyrazin-2-ylmethanamine?
The IUPAC name of (2-bromophenyl)-pyrazin-2-ylmethanamine (CID 63970477) is (2-bromophenyl)-pyrazin-2-ylmethanamine.
What is the SMILES notation for (2-bromophenyl)-pyrazin-2-ylmethanamine?
The canonical SMILES for (2-bromophenyl)-pyrazin-2-ylmethanamine is NC(c1cnccn1)c1ccccc1Br.
What is the InChIKey of (2-bromophenyl)-pyrazin-2-ylmethanamine?
The InChIKey is BFMDXJFKVYKLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN3/c12-9-4-2-1-3-8(9)11(13)10-7-14-5-6-15-10/h1-7,11H,13H2.
What are the key properties of (2-bromophenyl)-pyrazin-2-ylmethanamine?
(2-bromophenyl)-pyrazin-2-ylmethanamine has a molecular weight of 264.13 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-pyrazin-2-ylmethanamine is sourced from PubChem (CID 63970477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).