(3-chloroquinoxalin-2-yl)methylidenehydrazine

C9H7ClN4 — CID 71329398

IUPAC(3-chloroquinoxalin-2-yl)methylidenehydrazine
SMILESNN=Cc1nc2ccccc2nc1Cl
InChIInChI=1S/C9H7ClN4/c10-9-8(5-12-11)13-6-3-1-2-4-7(6)14-9/h1-5H,11H2
InChIKeyMRCXIXSJSJAYJP-UHFFFAOYSA-N
MW206.64 g/mol
LogP1.58
Rot. Bonds1

About (3-chloroquinoxalin-2-yl)methylidenehydrazine

(3-chloroquinoxalin-2-yl)methylidenehydrazine (PubChem CID 71329398) has the molecular formula C9H7ClN4 and a molecular weight of 206.64 g/mol. Its IUPAC name is (3-chloroquinoxalin-2-yl)methylidenehydrazine.

Molecular Properties

Compound Name(3-chloroquinoxalin-2-yl)methylidenehydrazine
PubChem CID71329398
Molecular FormulaC9H7ClN4
Molecular Weight206.64 g/mol
Exact Mass206.04
IUPAC Name(3-chloroquinoxalin-2-yl)methylidenehydrazine
SMILESNN=Cc1nc2ccccc2nc1Cl
InChIInChI=1S/C9H7ClN4/c10-9-8(5-12-11)13-6-3-1-2-4-7(6)14-9/h1-5H,11H2
InChIKeyMRCXIXSJSJAYJP-UHFFFAOYSA-N
XLogP1.58
TPSA64.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.64
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3-chloroquinoxalin-2-yl)methylidenehydrazine?
The IUPAC name of (3-chloroquinoxalin-2-yl)methylidenehydrazine (CID 71329398) is (3-chloroquinoxalin-2-yl)methylidenehydrazine.
What is the SMILES notation for (3-chloroquinoxalin-2-yl)methylidenehydrazine?
The canonical SMILES for (3-chloroquinoxalin-2-yl)methylidenehydrazine is NN=Cc1nc2ccccc2nc1Cl.
What is the InChIKey of (3-chloroquinoxalin-2-yl)methylidenehydrazine?
The InChIKey is MRCXIXSJSJAYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN4/c10-9-8(5-12-11)13-6-3-1-2-4-7(6)14-9/h1-5H,11H2.
What are the key properties of (3-chloroquinoxalin-2-yl)methylidenehydrazine?
(3-chloroquinoxalin-2-yl)methylidenehydrazine has a molecular weight of 206.64 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloroquinoxalin-2-yl)methylidenehydrazine is sourced from PubChem (CID 71329398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).