3,5-dibromo-N,N-diethylpyrazin-2-amine

C8H11Br2N3 — CID 87371010

IUPAC3,5-dibromo-N,N-diethylpyrazin-2-amine
SMILESCCN(CC)c1ncc(Br)nc1Br
InChIInChI=1S/C8H11Br2N3/c1-3-13(4-2)8-7(10)12-6(9)5-11-8/h5H,3-4H2,1-2H3
InChIKeyWGTPQLVSXKMUJE-UHFFFAOYSA-N
MW309.01 g/mol
LogP2.85
Rot. Bonds3

About 3,5-dibromo-N,N-diethylpyrazin-2-amine

3,5-dibromo-N,N-diethylpyrazin-2-amine (PubChem CID 87371010) has the molecular formula C8H11Br2N3 and a molecular weight of 309.01 g/mol. Its IUPAC name is 3,5-dibromo-N,N-diethylpyrazin-2-amine.

Molecular Properties

Compound Name3,5-dibromo-N,N-diethylpyrazin-2-amine
PubChem CID87371010
Molecular FormulaC8H11Br2N3
Molecular Weight309.01 g/mol
Exact Mass306.93
IUPAC Name3,5-dibromo-N,N-diethylpyrazin-2-amine
SMILESCCN(CC)c1ncc(Br)nc1Br
InChIInChI=1S/C8H11Br2N3/c1-3-13(4-2)8-7(10)12-6(9)5-11-8/h5H,3-4H2,1-2H3
InChIKeyWGTPQLVSXKMUJE-UHFFFAOYSA-N
XLogP2.85
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.01
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,5-dibromo-N,N-diethylpyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dibromo-N-(2-methoxyethyl)-N-methylpyrazin-2-amine
CID 87370694
sodium;3,5-dibromo-N-(2-methoxyethyl)-N-methylpyrazin-2-amine;hydride
CID 87940756
3,5-dibromopyrazin-2-olate
CID 51426326
3,5-dibromopyrazin-2-amine;ethane
CID 143486522
5-bromo-2-(diethylamino)pyridine-3-carboxylic acid
CID 59700072
6-bromo-N,N-diethylimidazo[1,2-a]pyrazin-8-amine
CID 79955501
4-bromo-N,N-diethylthieno[2,3-c]pyridin-7-amine
CID 130572518
3-bromo-N,N-diethylpyridin-2-amine
CID 61374664
3,5-dibromo-2-fluoropyrazine
CID 91457424
3-bromo-N,N-diethyl-4-methylpyridin-2-amine
CID 106876527
3,6-dibromopyrazin-2-amine;ethane
CID 143578228
3,5-dibromo-N,N-diethylpyridin-4-amine
CID 22715019

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N,N-diethylpyrazin-2-amine?
The IUPAC name of 3,5-dibromo-N,N-diethylpyrazin-2-amine (CID 87371010) is 3,5-dibromo-N,N-diethylpyrazin-2-amine.
What is the SMILES notation for 3,5-dibromo-N,N-diethylpyrazin-2-amine?
The canonical SMILES for 3,5-dibromo-N,N-diethylpyrazin-2-amine is CCN(CC)c1ncc(Br)nc1Br.
What is the InChIKey of 3,5-dibromo-N,N-diethylpyrazin-2-amine?
The InChIKey is WGTPQLVSXKMUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11Br2N3/c1-3-13(4-2)8-7(10)12-6(9)5-11-8/h5H,3-4H2,1-2H3.
What are the key properties of 3,5-dibromo-N,N-diethylpyrazin-2-amine?
3,5-dibromo-N,N-diethylpyrazin-2-amine has a molecular weight of 309.01 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N,N-diethylpyrazin-2-amine is sourced from PubChem (CID 87371010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).