(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine

C7H8BrN3 — CID 146532097

IUPAC(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine
SMILESN/C=C\Nc1ccc(Br)cn1
InChIInChI=1S/C7H8BrN3/c8-6-1-2-7(11-5-6)10-4-3-9/h1-5H,9H2,(H,10,11)/b4-3-
InChIKeyCGUUVUAZYXDDLI-ARJAWSKDSA-N
MW214.07 g/mol
LogP1.69
Rot. Bonds2

About (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine

(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine (PubChem CID 146532097) has the molecular formula C7H8BrN3 and a molecular weight of 214.07 g/mol. Its IUPAC name is (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine
PubChem CID146532097
Molecular FormulaC7H8BrN3
Molecular Weight214.07 g/mol
Exact Mass212.99
IUPAC Name(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine
SMILESN/C=C\Nc1ccc(Br)cn1
InChIInChI=1S/C7H8BrN3/c8-6-1-2-7(11-5-6)10-4-3-9/h1-5H,9H2,(H,10,11)/b4-3-
InChIKeyCGUUVUAZYXDDLI-ARJAWSKDSA-N
XLogP1.69
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.07
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine?
The IUPAC name of (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine (CID 146532097) is (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine?
The canonical SMILES for (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine is N/C=C\Nc1ccc(Br)cn1.
What is the InChIKey of (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine?
The InChIKey is CGUUVUAZYXDDLI-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H8BrN3/c8-6-1-2-7(11-5-6)10-4-3-9/h1-5H,9H2,(H,10,11)/b4-3-.
What are the key properties of (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine?
(Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine has a molecular weight of 214.07 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-(5-bromo-2-pyridinyl)ethene-1,2-diamine is sourced from PubChem (CID 146532097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).