2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline

C15H11FN4 — CID 174698734

IUPAC2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline
SMILESFc1ccccc1NN=Cc1ccc2nccnc2c1
InChIInChI=1S/C15H11FN4/c16-12-3-1-2-4-13(12)20-19-10-11-5-6-14-15(9-11)18-8-7-17-14/h1-10,20H
InChIKeyWYMNPPHEIMYEBL-UHFFFAOYSA-N
MW266.28 g/mol
LogP3.21
Rot. Bonds3

About 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline

2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline (PubChem CID 174698734) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline.

Molecular Properties

Compound Name2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline
PubChem CID174698734
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC Name2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline
SMILESFc1ccccc1NN=Cc1ccc2nccnc2c1
InChIInChI=1S/C15H11FN4/c16-12-3-1-2-4-13(12)20-19-10-11-5-6-14-15(9-11)18-8-7-17-14/h1-10,20H
InChIKeyWYMNPPHEIMYEBL-UHFFFAOYSA-N
XLogP3.21
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 53.21
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

4-fluoro-N-[(E)-quinoxalin-6-ylmethylideneamino]aniline
CID 175279468
4-bromo-N-[(E)-quinoxalin-6-ylmethylideneamino]aniline
CID 174698700
2,4,6-trichloro-N-(quinoxalin-6-ylmethylideneamino)aniline
CID 4316664
N-[(E)-quinoxalin-6-ylmethylideneamino]-4-(trifluoromethoxy)aniline
CID 172930208
6-chloro-4-phenyl-N-[(Z)-quinoxalin-6-ylmethylideneamino]quinazolin-2-amine
CID 6184611
N-[(E)-(3-fluorophenyl)methylideneamino]quinolin-4-amine
CID 45481342
N-[(E)-(2-fluorophenyl)methylideneamino]quinolin-4-amine
CID 45481082
2-fluoro-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]aniline
CID 164513023
4-[(E)-[(2-fluorophenyl)hydrazinylidene]methyl]-2,6-dimethoxyphenol
CID 135858157
N-[(2-fluorophenyl)methylideneamino]-6-(trifluoromethyl)quinolin-4-amine
CID 44537131
N-[(Z)-naphthalen-2-ylmethylideneamino]quinolin-8-amine
CID 7721506
N-[(E)-(3-fluorophenyl)methylideneamino]quinolin-8-amine
CID 19164942

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline?
The IUPAC name of 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline (CID 174698734) is 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline.
What is the SMILES notation for 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline?
The canonical SMILES for 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline is Fc1ccccc1NN=Cc1ccc2nccnc2c1.
What is the InChIKey of 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline?
The InChIKey is WYMNPPHEIMYEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c16-12-3-1-2-4-13(12)20-19-10-11-5-6-14-15(9-11)18-8-7-17-14/h1-10,20H.
What are the key properties of 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline?
2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline has a molecular weight of 266.28 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(quinoxalin-6-ylmethylideneamino)aniline is sourced from PubChem (CID 174698734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).