N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

C12H9ClF4N4 — CID 102720564

IUPACN-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESNNc1cc(C(F)(F)F)cc(Nc2ccc(Cl)cc2F)n1
InChIInChI=1S/C12H9ClF4N4/c13-7-1-2-9(8(14)5-7)19-10-3-6(12(15,16)17)4-11(20-10)21-18/h1-5H,18H2,(H2,19,20,21)
InChIKeyLPYMJTXWYZINGG-UHFFFAOYSA-N
MW320.68 g/mol
LogP3.92
Rot. Bonds3

About N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine

N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102720564) has the molecular formula C12H9ClF4N4 and a molecular weight of 320.68 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102720564
Molecular FormulaC12H9ClF4N4
Molecular Weight320.68 g/mol
Exact Mass320.05
IUPAC NameN-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
SMILESNNc1cc(C(F)(F)F)cc(Nc2ccc(Cl)cc2F)n1
InChIInChI=1S/C12H9ClF4N4/c13-7-1-2-9(8(14)5-7)19-10-3-6(12(15,16)17)4-11(20-10)21-18/h1-5H,18H2,(H2,19,20,21)
InChIKeyLPYMJTXWYZINGG-UHFFFAOYSA-N
XLogP3.92
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.68
LogP ≤ 53.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-difluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720931
6-N-(4-chloro-2-fluorophenyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717889
N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80897846
N-(3-chloro-5-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 107371209
6-chloro-N-(5-chloro-2-fluorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715497
4-N-[4-chloro-2-(trifluoromethyl)phenyl]-6-hydrazinylpyrimidine-2,4-diamine
CID 80911630
N-(3-chloro-2-methylphenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720917
N-(2,4-difluorophenyl)-6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775940
N-(4-chloro-2-iodophenyl)-6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 107639573
6-N-(4-bromo-2-fluorophenyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717020
N-(2-bromo-5-methylphenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102721054
4-N-(2,4-dichlorophenyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80921104

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine (CID 102720564) is N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is NNc1cc(C(F)(F)F)cc(Nc2ccc(Cl)cc2F)n1.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is LPYMJTXWYZINGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClF4N4/c13-7-1-2-9(8(14)5-7)19-10-3-6(12(15,16)17)4-11(20-10)21-18/h1-5H,18H2,(H2,19,20,21).
What are the key properties of N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine?
N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 320.68 g/mol, XLogP of 3.92, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102720564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).