N-[(2,5-difluorophenyl)methylideneamino]aniline

C13H10F2N2 — CID 169381510

IUPACN-[(2,5-difluorophenyl)methylideneamino]aniline
SMILESFc1ccc(F)c(C=NNc2ccccc2)c1
InChIInChI=1S/C13H10F2N2/c14-11-6-7-13(15)10(8-11)9-16-17-12-4-2-1-3-5-12/h1-9,17H
InChIKeyFMQKXLROFJYYTA-UHFFFAOYSA-N
MW232.23 g/mol
LogP3.41
Rot. Bonds3

About N-[(2,5-difluorophenyl)methylideneamino]aniline

N-[(2,5-difluorophenyl)methylideneamino]aniline (PubChem CID 169381510) has the molecular formula C13H10F2N2 and a molecular weight of 232.23 g/mol. Its IUPAC name is N-[(2,5-difluorophenyl)methylideneamino]aniline.

Molecular Properties

Compound NameN-[(2,5-difluorophenyl)methylideneamino]aniline
PubChem CID169381510
Molecular FormulaC13H10F2N2
Molecular Weight232.23 g/mol
Exact Mass232.08
IUPAC NameN-[(2,5-difluorophenyl)methylideneamino]aniline
SMILESFc1ccc(F)c(C=NNc2ccccc2)c1
InChIInChI=1S/C13H10F2N2/c14-11-6-7-13(15)10(8-11)9-16-17-12-4-2-1-3-5-12/h1-9,17H
InChIKeyFMQKXLROFJYYTA-UHFFFAOYSA-N
XLogP3.41
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-2-[(phenylhydrazinylidene)methyl]phenol
CID 169381557
N-[(2-fluoro-5-methylphenyl)methylideneamino]aniline
CID 169381612
N-[(2,3,5-trifluorophenyl)methylideneamino]aniline
CID 169381722
trifluoro-[4-fluoro-2-[(phenylhydrazinylidene)methyl]phenyl]boranuide
CID 169384176
N-[(2-bromo-4-fluorophenyl)methylideneamino]aniline
CID 169381492
N-[(2-chloro-3,5-difluorophenyl)methylideneamino]aniline
CID 169382591
N-[(2,3-dibromo-5-fluorophenyl)methylideneamino]aniline
CID 169383720
N-[(Z)-(3,4-difluorophenyl)methylideneamino]aniline
CID 6107807
N-[[2-[(3,4-difluorophenyl)methoxy]-4-fluorophenyl]methylideneamino]aniline
CID 169382106
N-[(2,4-difluoro-3-methylphenyl)methylideneamino]aniline
CID 169381777
1-(2,5-difluorophenyl)-N-phenylmethanimine
CID 23340889
N-[(3,5-difluorophenyl)methylideneamino]aniline
CID 169381503

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-difluorophenyl)methylideneamino]aniline?
The IUPAC name of N-[(2,5-difluorophenyl)methylideneamino]aniline (CID 169381510) is N-[(2,5-difluorophenyl)methylideneamino]aniline.
What is the SMILES notation for N-[(2,5-difluorophenyl)methylideneamino]aniline?
The canonical SMILES for N-[(2,5-difluorophenyl)methylideneamino]aniline is Fc1ccc(F)c(C=NNc2ccccc2)c1.
What is the InChIKey of N-[(2,5-difluorophenyl)methylideneamino]aniline?
The InChIKey is FMQKXLROFJYYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2/c14-11-6-7-13(15)10(8-11)9-16-17-12-4-2-1-3-5-12/h1-9,17H.
What are the key properties of N-[(2,5-difluorophenyl)methylideneamino]aniline?
N-[(2,5-difluorophenyl)methylideneamino]aniline has a molecular weight of 232.23 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-difluorophenyl)methylideneamino]aniline is sourced from PubChem (CID 169381510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).