[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine

C13H16F2N4 — CID 102804856

IUPAC[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1nn(C)cc1C(Cc1cccc(F)c1F)NN
InChIInChI=1S/C13H16F2N4/c1-8-10(7-19(2)18-8)12(17-16)6-9-4-3-5-11(14)13(9)15/h3-5,7,12,17H,6,16H2,1-2H3
InChIKeyYHHGSAGWIQKFSH-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.75
Rot. Bonds4

About [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine

[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine (PubChem CID 102804856) has the molecular formula C13H16F2N4 and a molecular weight of 266.30 g/mol. Its IUPAC name is [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine
PubChem CID102804856
Molecular FormulaC13H16F2N4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine
SMILESCc1nn(C)cc1C(Cc1cccc(F)c1F)NN
InChIInChI=1S/C13H16F2N4/c1-8-10(7-19(2)18-8)12(17-16)6-9-4-3-5-11(14)13(9)15/h3-5,7,12,17H,6,16H2,1-2H3
InChIKeyYHHGSAGWIQKFSH-UHFFFAOYSA-N
XLogP1.75
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
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-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]propan-1-amine
CID 102803334
[2-(2,3-difluorophenyl)-1-(3-methylimidazol-4-yl)ethyl]hydrazine
CID 105264766
[1-(1,3-dimethylpyrazol-4-yl)-2-quinolin-4-ylethyl]hydrazine
CID 102805020
[1-(1,3-dimethylpyrazol-4-yl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 102805146
[2-(2,3-difluorophenyl)-1-(5-methylpyrazin-2-yl)ethyl]hydrazine
CID 105297985
[2-(3-chloro-4-pyridinyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine
CID 102805005
2-(2-chloro-3-fluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethanol
CID 112653181
1-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)-N-methylmethanamine
CID 102803776
N-[2-(2,6-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]propan-1-amine
CID 102804658
[2-(2,3-difluorophenyl)-1-(4-methoxy-2-methylphenyl)ethyl]hydrazine
CID 105291525
[2-(2,3-difluorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105256977
[2-(3-chloro-2-fluorophenyl)-1-(2,3-difluorophenyl)ethyl]hydrazine
CID 105264357

Frequently Asked Questions

What is the IUPAC name of [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine (CID 102804856) is [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine is Cc1nn(C)cc1C(Cc1cccc(F)c1F)NN.
What is the InChIKey of [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine?
The InChIKey is YHHGSAGWIQKFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N4/c1-8-10(7-19(2)18-8)12(17-16)6-9-4-3-5-11(14)13(9)15/h3-5,7,12,17H,6,16H2,1-2H3.
What are the key properties of [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine?
[2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine has a molecular weight of 266.30 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-difluorophenyl)-1-(1,3-dimethylpyrazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 102804856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).