[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine

C10H12ClFN6 — CID 107066044

IUPAC[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2ccc(F)cc2Cl)n1
InChIInChI=1S/C10H12ClFN6/c1-18-16-10(15-17-18)5-9(14-13)7-3-2-6(12)4-8(7)11/h2-4,9,14H,5,13H2,1H3
InChIKeyNDUBNKMFLYBGLQ-UHFFFAOYSA-N
MW270.70 g/mol
LogP0.75
Rot. Bonds4

About [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine

[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine (PubChem CID 107066044) has the molecular formula C10H12ClFN6 and a molecular weight of 270.70 g/mol. Its IUPAC name is [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
PubChem CID107066044
Molecular FormulaC10H12ClFN6
Molecular Weight270.70 g/mol
Exact Mass270.08
IUPAC Name[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2ccc(F)cc2Cl)n1
InChIInChI=1S/C10H12ClFN6/c1-18-16-10(15-17-18)5-9(14-13)7-3-2-6(12)4-8(7)11/h2-4,9,14H,5,13H2,1H3
InChIKeyNDUBNKMFLYBGLQ-UHFFFAOYSA-N
XLogP0.75
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.70
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[1-(5-bromo-2-chlorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066756
5-chloro-2-[1-hydrazinyl-2-(2-methyltetrazol-5-yl)ethyl]aniline
CID 107066106
[1-(2-chloro-4-fluorophenyl)-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105215355
[1-(2-bromo-4-methylphenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066919
[1-(2-chloro-4-fluorophenyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105215350
N-ethyl-1-(4-fluoro-2-methylphenyl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050491
[1-(2-chloro-4-fluorophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethyl]hydrazine
CID 105215278
[1-(5-fluoro-3-pyridinyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066996
[1-(2,5-dibromophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066786
2-[1-hydrazinyl-2-(2-methyltetrazol-5-yl)ethyl]-4-(trifluoromethyl)aniline
CID 107066373
[1-(2,4-difluorophenyl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine
CID 107066099
[1-(2-chloro-4-fluorophenyl)-4-methylpentyl]hydrazine
CID 105215256

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine (CID 107066044) is [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine is Cn1nnc(CC(NN)c2ccc(F)cc2Cl)n1.
What is the InChIKey of [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The InChIKey is NDUBNKMFLYBGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClFN6/c1-18-16-10(15-17-18)5-9(14-13)7-3-2-6(12)4-8(7)11/h2-4,9,14H,5,13H2,1H3.
What are the key properties of [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
[1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine has a molecular weight of 270.70 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-4-fluorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 107066044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).