2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide

C9H10ClFN2O — CID 116846232

IUPAC2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide
SMILESCNNC(=O)Cc1cc(Cl)ccc1F
InChIInChI=1S/C9H10ClFN2O/c1-12-13-9(14)5-6-4-7(10)2-3-8(6)11/h2-4,12H,5H2,1H3,(H,13,14)
InChIKeyLAKZARDKESKJOF-UHFFFAOYSA-N
MW216.64 g/mol
LogP1.27
Rot. Bonds3

About 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide

2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide (PubChem CID 116846232) has the molecular formula C9H10ClFN2O and a molecular weight of 216.64 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide
PubChem CID116846232
Molecular FormulaC9H10ClFN2O
Molecular Weight216.64 g/mol
Exact Mass216.05
IUPAC Name2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide
SMILESCNNC(=O)Cc1cc(Cl)ccc1F
InChIInChI=1S/C9H10ClFN2O/c1-12-13-9(14)5-6-4-7(10)2-3-8(6)11/h2-4,12H,5H2,1H3,(H,13,14)
InChIKeyLAKZARDKESKJOF-UHFFFAOYSA-N
XLogP1.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.64
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(5-chloro-2-fluorophenyl)methyl]-3-oxobutanamide
CID 115176410
2-(5-chloro-2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
CID 82475017
2-[[2-(5-chloro-2-fluorophenyl)acetyl]amino]acetic acid
CID 82479206
3-(5-bromo-2-fluorophenyl)-N'-methylpropanehydrazide
CID 116846409
1-(5-chloro-2-fluorophenyl)-3-methoxybutan-2-one
CID 103048080
N-tert-butyl-2-[(5-chloro-2-fluorophenyl)methylamino]acetamide
CID 115761650
N-[(5-chloro-2-fluorophenyl)methyl]-N-methyl-3-oxobutanamide
CID 115176479
N-[(5-chloro-2-fluorophenyl)methyl]-3-sulfanylpropanamide
CID 115167873
tert-butyl N-[(5-chloro-2-fluorophenyl)methylamino]carbamate
CID 107237313
2-[(5-chloro-2-fluorophenyl)methoxy]acetohydrazide
CID 116845510
1-(5-chloro-2-fluorophenyl)-3-(4-hydroxyphenyl)propan-2-one
CID 161028075
2-(5-chloro-2-fluorophenyl)-1-(1-methylcyclopropyl)ethanone
CID 103048097

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide (CID 116846232) is 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide is CNNC(=O)Cc1cc(Cl)ccc1F.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide?
The InChIKey is LAKZARDKESKJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClFN2O/c1-12-13-9(14)5-6-4-7(10)2-3-8(6)11/h2-4,12H,5H2,1H3,(H,13,14).
What are the key properties of 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide?
2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide has a molecular weight of 216.64 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-N'-methylacetohydrazide is sourced from PubChem (CID 116846232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).