3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine

C15H10Cl2N4 — CID 6243010

IUPAC3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine
SMILESClc1ccccc1/C=N\Nc1nc2ccccc2nc1Cl
InChIInChI=1S/C15H10Cl2N4/c16-11-6-2-1-5-10(11)9-18-21-15-14(17)19-12-7-3-4-8-13(12)20-15/h1-9H,(H,20,21)/b18-9-
InChIKeyUDGYMXDHDUSGDM-NVMNQCDNSA-N
MW317.18 g/mol
LogP4.38
Rot. Bonds3

About 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine

3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine (PubChem CID 6243010) has the molecular formula C15H10Cl2N4 and a molecular weight of 317.18 g/mol. Its IUPAC name is 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine.

Molecular Properties

Compound Name3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine
PubChem CID6243010
Molecular FormulaC15H10Cl2N4
Molecular Weight317.18 g/mol
Exact Mass316.03
IUPAC Name3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine
SMILESClc1ccccc1/C=N\Nc1nc2ccccc2nc1Cl
InChIInChI=1S/C15H10Cl2N4/c16-11-6-2-1-5-10(11)9-18-21-15-14(17)19-12-7-3-4-8-13(12)20-15/h1-9H,(H,20,21)/b18-9-
InChIKeyUDGYMXDHDUSGDM-NVMNQCDNSA-N
XLogP4.38
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.18
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[(2-chlorophenyl)methylidene]hydrazinyl]-1H-quinoxalin-2-one
CID 3850152
3-chloro-N-[(4-methylsulfanylphenyl)methylideneamino]quinoxalin-2-amine
CID 3292221
4-[2-[(2-chlorophenyl)methylidene]hydrazinyl]phenol
CID 4174590
methyl 4-[(E)-[(3-chloroquinoxalin-2-yl)hydrazinylidene]methyl]benzoate
CID 56725889
3-chloro-N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]quinoxalin-2-amine
CID 56725881
5-[2-[(2-chlorophenyl)methylidene]hydrazinyl]-2H-1,2,4-triazin-3-one
CID 2789166
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-3-(trifluoromethyl)quinoxalin-2-amine
CID 6052706
2-[2-[(2-chlorophenyl)methylidene]hydrazinyl]-3-hydroxyquinazolin-4-one
CID 4897068
N-[(2-chlorophenyl)methylideneamino]-4,5-dimethyl-1,3-thiazol-2-amine
CID 4074619
N-[(Z)-(2-fluorophenyl)methylideneamino]-3-(trifluoromethyl)quinoxalin-2-amine
CID 6040000
2-(2-chlorophenyl)-N-[(2-fluorophenyl)methylideneamino]quinazolin-4-amine
CID 3764445
N-[(2-chlorophenyl)methylideneamino]-2,6-dimethylquinolin-4-amine
CID 44537092

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine?
The IUPAC name of 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine (CID 6243010) is 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine.
What is the SMILES notation for 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine?
The canonical SMILES for 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine is Clc1ccccc1/C=N\Nc1nc2ccccc2nc1Cl.
What is the InChIKey of 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine?
The InChIKey is UDGYMXDHDUSGDM-NVMNQCDNSA-N. The full InChI is InChI=1S/C15H10Cl2N4/c16-11-6-2-1-5-10(11)9-18-21-15-14(17)19-12-7-3-4-8-13(12)20-15/h1-9H,(H,20,21)/b18-9-.
What are the key properties of 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine?
3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine has a molecular weight of 317.18 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[(Z)-(2-chlorophenyl)methylideneamino]quinoxalin-2-amine is sourced from PubChem (CID 6243010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).