N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide

C10H11FN2 — CID 154967900

IUPACN'-[1-(4-fluorophenyl)ethenyl]ethanimidamide
SMILESC=C(/N=C(\C)N)c1ccc(F)cc1
InChIInChI=1S/C10H11FN2/c1-7(13-8(2)12)9-3-5-10(11)6-4-9/h3-6H,1H2,2H3,(H2,12,13)
InChIKeyNEEMWSLSJMINBJ-UHFFFAOYSA-N
MW178.21 g/mol
LogP2.17
Rot. Bonds2

About N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide

N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide (PubChem CID 154967900) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide.

Molecular Properties

Compound NameN'-[1-(4-fluorophenyl)ethenyl]ethanimidamide
PubChem CID154967900
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC NameN'-[1-(4-fluorophenyl)ethenyl]ethanimidamide
SMILESC=C(/N=C(\C)N)c1ccc(F)cc1
InChIInChI=1S/C10H11FN2/c1-7(13-8(2)12)9-3-5-10(11)6-4-9/h3-6H,1H2,2H3,(H2,12,13)
InChIKeyNEEMWSLSJMINBJ-UHFFFAOYSA-N
XLogP2.17
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-[1-[4-(2-hydroxypropan-2-yl)phenyl]ethenyl]ethanimidamide
CID 145194732
N'-[1-(2,6-difluorophenyl)ethenyl]ethanimidamide
CID 123611073
N-(1-aminoethylideneamino)-4-fluorobenzamide
CID 86065871
1-[4-(4-fluorophenyl)phenyl]ethenol
CID 143634078
2-[amino-(4-fluorophenyl)methylidene]propanedinitrile
CID 89407680
1-(4-fluorophenyl)ethenylsilane
CID 175020263
N'-amino-4-fluorobenzenecarboximidamide;hydrochloride
CID 68690299
1-(1-bromoprop-1-en-2-yl)-4-fluorobenzene
CID 86644757
1-(4-fluorophenyl)ethenylhydrazine
CID 70318668
1-(4-fluorophenyl)-N,N-dimethylethenamine
CID 54285953
chloromethane;4-fluorobenzamide
CID 158476805
N'-methyl-2-(1-phenylethenylimino)propanimidamide
CID 123327776

Frequently Asked Questions

What is the IUPAC name of N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide?
The IUPAC name of N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide (CID 154967900) is N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide.
What is the SMILES notation for N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide?
The canonical SMILES for N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide is C=C(/N=C(\C)N)c1ccc(F)cc1.
What is the InChIKey of N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide?
The InChIKey is NEEMWSLSJMINBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c1-7(13-8(2)12)9-3-5-10(11)6-4-9/h3-6H,1H2,2H3,(H2,12,13).
What are the key properties of N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide?
N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide has a molecular weight of 178.21 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(4-fluorophenyl)ethenyl]ethanimidamide is sourced from PubChem (CID 154967900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).