N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine

C12H11BrCl2N4 — CID 102762492

IUPACN-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
SMILESCc1ccc(Br)c(Nc2nc(NN)c(Cl)cc2Cl)c1
InChIInChI=1S/C12H11BrCl2N4/c1-6-2-3-7(13)10(4-6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19)
InChIKeyCMPPZLLZWWCEJY-UHFFFAOYSA-N
MW362.06 g/mol
LogP4.49
Rot. Bonds3

About N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine

N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine (PubChem CID 102762492) has the molecular formula C12H11BrCl2N4 and a molecular weight of 362.06 g/mol. Its IUPAC name is N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
PubChem CID102762492
Molecular FormulaC12H11BrCl2N4
Molecular Weight362.06 g/mol
Exact Mass359.95
IUPAC NameN-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
SMILESCc1ccc(Br)c(Nc2nc(NN)c(Cl)cc2Cl)c1
InChIInChI=1S/C12H11BrCl2N4/c1-6-2-3-7(13)10(4-6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19)
InChIKeyCMPPZLLZWWCEJY-UHFFFAOYSA-N
XLogP4.49
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.06
LogP ≤ 54.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3,5-dichloro-6-hydrazinyl-N-(2-methoxy-5-methylphenyl)pyridin-2-amine
CID 102762320
5-bromo-N-(2-bromo-5-methylphenyl)-2-chloropyrimidin-4-amine
CID 82766176
(2-bromo-5-methylphenyl)hydrazine
CID 12891837
N-(4-bromo-3,5-dimethylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
CID 107581024
3,5-dichloro-6-hydrazinyl-N-(5-iodo-2-methylphenyl)pyridin-2-amine
CID 114258206
N-(5-bromo-2-methoxyphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
CID 102761817
3-bromo-4-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)amino]benzonitrile
CID 107795514
3,5-dichloro-6-N-(2,5-dibromophenyl)-2-N-ethylpyridine-2,6-diamine
CID 102756861
2-N-(2-bromo-5-methylphenyl)-4,5-dichlorobenzene-1,2-diamine
CID 82761644
4-N-(2-bromo-5-methylphenyl)-5-chloro-2-N-propylpyrimidine-2,4-diamine
CID 82758297
N-(2-bromo-5-chlorophenyl)-3,5-difluoro-6-hydrazinylpyridin-2-amine
CID 114073489
N-(2-bromo-5-methylphenyl)-6-hydrazinylpyrazin-2-amine
CID 82758106

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine?
The IUPAC name of N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine (CID 102762492) is N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine?
The canonical SMILES for N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine is Cc1ccc(Br)c(Nc2nc(NN)c(Cl)cc2Cl)c1.
What is the InChIKey of N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine?
The InChIKey is CMPPZLLZWWCEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrCl2N4/c1-6-2-3-7(13)10(4-6)17-11-8(14)5-9(15)12(18-11)19-16/h2-5H,16H2,1H3,(H2,17,18,19).
What are the key properties of N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine?
N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine has a molecular weight of 362.06 g/mol, XLogP of 4.49, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 102762492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).