(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine

C9H12FN3 — CID 138631129

IUPAC(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine
SMILESCN/C=C(\NN)c1ccccc1F
InChIInChI=1S/C9H12FN3/c1-12-6-9(13-11)7-4-2-3-5-8(7)10/h2-6,12-13H,11H2,1H3/b9-6-
InChIKeyQZUOSEIKGUWQLU-TWGQIWQCSA-N
MW181.21 g/mol
LogP0.81
Rot. Bonds3

About (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine

(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine (PubChem CID 138631129) has the molecular formula C9H12FN3 and a molecular weight of 181.21 g/mol. Its IUPAC name is (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine.

Molecular Properties

Compound Name(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine
PubChem CID138631129
Molecular FormulaC9H12FN3
Molecular Weight181.21 g/mol
Exact Mass181.10
IUPAC Name(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine
SMILESCN/C=C(\NN)c1ccccc1F
InChIInChI=1S/C9H12FN3/c1-12-6-9(13-11)7-4-2-3-5-8(7)10/h2-6,12-13H,11H2,1H3/b9-6-
InChIKeyQZUOSEIKGUWQLU-TWGQIWQCSA-N
XLogP0.81
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine?
The IUPAC name of (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine (CID 138631129) is (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine.
What is the SMILES notation for (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine?
The canonical SMILES for (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine is CN/C=C(\NN)c1ccccc1F.
What is the InChIKey of (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine?
The InChIKey is QZUOSEIKGUWQLU-TWGQIWQCSA-N. The full InChI is InChI=1S/C9H12FN3/c1-12-6-9(13-11)7-4-2-3-5-8(7)10/h2-6,12-13H,11H2,1H3/b9-6-.
What are the key properties of (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine?
(Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine has a molecular weight of 181.21 g/mol, XLogP of 0.81, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(2-fluorophenyl)-2-hydrazinyl-N-methylethenamine is sourced from PubChem (CID 138631129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).