2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine

C8H11ClFN3 — CID 174466054

IUPAC2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine
SMILESNCCNNc1ccc(F)c(Cl)c1
InChIInChI=1S/C8H11ClFN3/c9-7-5-6(1-2-8(7)10)13-12-4-3-11/h1-2,5,12-13H,3-4,11H2
InChIKeyFEQYBLDOOMGJQD-UHFFFAOYSA-N
MW203.65 g/mol
LogP1.35
Rot. Bonds4

About 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine

2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine (PubChem CID 174466054) has the molecular formula C8H11ClFN3 and a molecular weight of 203.65 g/mol. Its IUPAC name is 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine.

Molecular Properties

Compound Name2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine
PubChem CID174466054
Molecular FormulaC8H11ClFN3
Molecular Weight203.65 g/mol
Exact Mass203.06
IUPAC Name2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine
SMILESNCCNNc1ccc(F)c(Cl)c1
InChIInChI=1S/C8H11ClFN3/c9-7-5-6(1-2-8(7)10)13-12-4-3-11/h1-2,5,12-13H,3-4,11H2
InChIKeyFEQYBLDOOMGJQD-UHFFFAOYSA-N
XLogP1.35
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.65
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-(3-chloro-4-fluoroanilino)carbamate
CID 12787058
3-chloro-4-fluoro-N-methylaniline;ethane
CID 142993697
N-(3-chloro-4-fluorophenyl)-N'-propan-2-ylethane-1,2-diamine
CID 54809625
N-(3-chloro-4-fluoroanilino)nitramide
CID 175062714
1-N-(3-chloro-4-fluorophenyl)-2-methylpropane-1,2-diamine
CID 83705089
N-(3-chloro-4-fluorophenyl)-1-phenylethane-1,2-diamine
CID 82133663
4-amino-N-(3-chloro-4-fluorophenyl)butanamide
CID 22692197
3-chloro-N-decyl-4-fluoroaniline
CID 83108687
2-[(3-chloro-4-fluoroanilino)methyl]-2-methylpropane-1,3-diol
CID 83108081
2-(3-chloro-4-fluorophenyl)-1,1-diethylhydrazine
CID 175273242
3-(3-chloro-4-fluoroanilino)-2-methylpropanethioamide
CID 82086359
3-chloro-N-[1-(4-chlorophenyl)propyl]-4-fluoroaniline
CID 43119213

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine?
The IUPAC name of 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine (CID 174466054) is 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine.
What is the SMILES notation for 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine?
The canonical SMILES for 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine is NCCNNc1ccc(F)c(Cl)c1.
What is the InChIKey of 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine?
The InChIKey is FEQYBLDOOMGJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClFN3/c9-7-5-6(1-2-8(7)10)13-12-4-3-11/h1-2,5,12-13H,3-4,11H2.
What are the key properties of 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine?
2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine has a molecular weight of 203.65 g/mol, XLogP of 1.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chloro-4-fluorophenyl)hydrazinyl]ethanamine is sourced from PubChem (CID 174466054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).