5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine

C10H8Br2ClN5 — CID 80896859

IUPAC5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine
SMILESNNc1ncc(Cl)c(Nc2ccc(Br)cc2Br)n1
InChIInChI=1S/C10H8Br2ClN5/c11-5-1-2-8(6(12)3-5)16-9-7(13)4-15-10(17-9)18-14/h1-4H,14H2,(H2,15,16,17,18)
InChIKeyLZKHKZYYFGVORC-UHFFFAOYSA-N
MW393.47 g/mol
LogP3.68
Rot. Bonds3

About 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine

5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine (PubChem CID 80896859) has the molecular formula C10H8Br2ClN5 and a molecular weight of 393.47 g/mol. Its IUPAC name is 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine.

Molecular Properties

Compound Name5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine
PubChem CID80896859
Molecular FormulaC10H8Br2ClN5
Molecular Weight393.47 g/mol
Exact Mass390.88
IUPAC Name5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine
SMILESNNc1ncc(Cl)c(Nc2ccc(Br)cc2Br)n1
InChIInChI=1S/C10H8Br2ClN5/c11-5-1-2-8(6(12)3-5)16-9-7(13)4-15-10(17-9)18-14/h1-4H,14H2,(H2,15,16,17,18)
InChIKeyLZKHKZYYFGVORC-UHFFFAOYSA-N
XLogP3.68
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 53.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-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

N-(2-bromophenyl)-5-chloro-2-hydrazinylpyrimidin-4-amine
CID 80927953
5-bromo-N-(2-bromo-4-methylphenyl)-2-hydrazinylpyrimidin-4-amine
CID 80930663
4-N-(4-bromo-2-methylphenyl)-5-chloro-2-N-methylpyrimidine-2,4-diamine
CID 80759455
5-chloro-N-[4-chloro-2-(trifluoromethyl)phenyl]-2-hydrazinylpyrimidin-4-amine
CID 80911957
5-chloro-2-hydrazinyl-N-(4-methoxy-2-methylphenyl)pyrimidin-4-amine
CID 80918932
5-chloro-2-hydrazinyl-N-naphthalen-1-ylpyrimidin-4-amine
CID 80930813
4-bromo-2-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]benzonitrile
CID 114002825
4-N-(2-bromophenyl)-5-chloro-2-N-methylpyrimidine-2,4-diamine
CID 80760837
5-bromo-N-(3-chloro-2-fluorophenyl)-2-hydrazinylpyrimidin-4-amine
CID 80921178
5-bromo-N-(3-chloro-2-methylphenyl)-2-hydrazinylpyrimidin-4-amine
CID 80927863
5-chloro-N-(2,6-dichloro-4-fluorophenyl)-2-hydrazinylpyrimidin-4-amine
CID 83082007
5-chloro-N-(3-chloro-4-methylphenyl)-2-hydrazinylpyrimidin-4-amine
CID 80931413

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine?
The IUPAC name of 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine (CID 80896859) is 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine.
What is the SMILES notation for 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine?
The canonical SMILES for 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine is NNc1ncc(Cl)c(Nc2ccc(Br)cc2Br)n1.
What is the InChIKey of 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine?
The InChIKey is LZKHKZYYFGVORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Br2ClN5/c11-5-1-2-8(6(12)3-5)16-9-7(13)4-15-10(17-9)18-14/h1-4H,14H2,(H2,15,16,17,18).
What are the key properties of 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine?
5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine has a molecular weight of 393.47 g/mol, XLogP of 3.68, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-dibromophenyl)-2-hydrazinylpyrimidin-4-amine is sourced from PubChem (CID 80896859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).