4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine

C8H6Br2N4 — CID 104777834

IUPAC4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine
SMILESNc1nn(-c2ccncc2Br)cc1Br
InChIInChI=1S/C8H6Br2N4/c9-5-3-12-2-1-7(5)14-4-6(10)8(11)13-14/h1-4H,(H2,11,13)
InChIKeyVTLYNKRJVBAGSP-UHFFFAOYSA-N
MW317.97 g/mol
LogP2.37
Rot. Bonds1

About 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine

4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine (PubChem CID 104777834) has the molecular formula C8H6Br2N4 and a molecular weight of 317.97 g/mol. Its IUPAC name is 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine.

Molecular Properties

Compound Name4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine
PubChem CID104777834
Molecular FormulaC8H6Br2N4
Molecular Weight317.97 g/mol
Exact Mass315.90
IUPAC Name4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine
SMILESNc1nn(-c2ccncc2Br)cc1Br
InChIInChI=1S/C8H6Br2N4/c9-5-3-12-2-1-7(5)14-4-6(10)8(11)13-14/h1-4H,(H2,11,13)
InChIKeyVTLYNKRJVBAGSP-UHFFFAOYSA-N
XLogP2.37
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.97
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-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

4-bromo-1-pyrazin-2-ylpyrazol-3-amine
CID 61176052
4-[1-(3-bromo-4-pyridinyl)pyrazol-4-yl]aniline
CID 104777835
3-bromo-4-(3-methyl-1,2,4-triazol-1-yl)pyridine
CID 166607440
1-(3-bromo-4-pyridinyl)-3,5-dimethylpyrazol-4-amine
CID 104777827
4-bromo-1-[2-(trifluoromethyl)phenyl]pyrazol-3-amine
CID 55062140
2-(3-amino-4-bromopyrazol-1-yl)benzonitrile
CID 61177381
3-bromo-4-(4-phenylpyrazol-1-yl)pyridine
CID 104778680
4-bromo-1-(4-chlorophenyl)pyrazol-3-amine
CID 83867278
1-(2-bromophenyl)-4-methylpyrazol-3-amine
CID 62677549
3-bromo-4-(3-methyl-1,2,4-triazol-4-yl)pyridine
CID 90199424
3-bromo-4-(4,5-dimethylimidazol-1-yl)pyridine
CID 104778676
3-bromo-4-(3,6-dihydro-2H-pyridin-1-yl)pyridine
CID 114412429

Frequently Asked Questions

What is the IUPAC name of 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine?
The IUPAC name of 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine (CID 104777834) is 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine.
What is the SMILES notation for 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine?
The canonical SMILES for 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine is Nc1nn(-c2ccncc2Br)cc1Br.
What is the InChIKey of 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine?
The InChIKey is VTLYNKRJVBAGSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Br2N4/c9-5-3-12-2-1-7(5)14-4-6(10)8(11)13-14/h1-4H,(H2,11,13).
What are the key properties of 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine?
4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine has a molecular weight of 317.97 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-1-(3-bromo-4-pyridinyl)pyrazol-3-amine is sourced from PubChem (CID 104777834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).