(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine

C8H8FN3O2 — CID 168531109

IUPAC(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine
SMILESCc1cc(F)c(C=NN)c([N+](=O)[O-])c1
InChIInChI=1S/C8H8FN3O2/c1-5-2-7(9)6(4-11-10)8(3-5)12(13)14/h2-4H,10H2,1H3
InChIKeyRLBZWGADUVLAKX-UHFFFAOYSA-N
MW197.17 g/mol
LogP1.33
Rot. Bonds2

About (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine

(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine (PubChem CID 168531109) has the molecular formula C8H8FN3O2 and a molecular weight of 197.17 g/mol. Its IUPAC name is (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine.

Molecular Properties

Compound Name(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine
PubChem CID168531109
Molecular FormulaC8H8FN3O2
Molecular Weight197.17 g/mol
Exact Mass197.06
IUPAC Name(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine
SMILESCc1cc(F)c(C=NN)c([N+](=O)[O-])c1
InChIInChI=1S/C8H8FN3O2/c1-5-2-7(9)6(4-11-10)8(3-5)12(13)14/h2-4H,10H2,1H3
InChIKeyRLBZWGADUVLAKX-UHFFFAOYSA-N
XLogP1.33
TPSA81.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.17
LogP ≤ 51.33
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': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2,6-dinitrophenyl)methylidenehydrazine
CID 168530907
2-fluoro-4-methyl-6-nitrobenzonitrile
CID 130981867
sodium 4-methyl-2,6-dinitrophenolate
CID 102438433
2-fluoro-5-methyl-3-nitrobenzenethiol
CID 130883668
1,4-dimethyl-2-nitrobenzene;1,2,3,4,5-pentafluoro-6-methylbenzene
CID 90772529
5-methyl-3-nitrobenzene-1,2-diol
CID 3976897
2-fluoro-1-methoxy-5-methyl-3-nitrobenzene
CID 131213041
1,4-dimethyl-2-nitrobenzene
CID 20849377
2-bromo-5-methyl-1-nitro-3-(trifluoromethyl)benzene
CID 119015313
2,5-dimethyl-3-nitrobenzamide
CID 119008464
2-(2,4-dimethyl-6-nitrophenyl)-3,5-dimethylaniline
CID 71332541
1,4-difluoro-2,5-dinitrobenzene
CID 14951568

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine?
The IUPAC name of (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine (CID 168531109) is (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine.
What is the SMILES notation for (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine?
The canonical SMILES for (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine is Cc1cc(F)c(C=NN)c([N+](=O)[O-])c1.
What is the InChIKey of (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine?
The InChIKey is RLBZWGADUVLAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN3O2/c1-5-2-7(9)6(4-11-10)8(3-5)12(13)14/h2-4H,10H2,1H3.
What are the key properties of (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine?
(2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine has a molecular weight of 197.17 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methyl-6-nitrophenyl)methylidenehydrazine is sourced from PubChem (CID 168531109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).