N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide

C16H14BrFN2O3 — CID 7809057

IUPACN'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
SMILESO=C(COc1ccc(Br)cc1)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14BrFN2O3/c17-12-5-7-13(8-6-12)23-10-16(22)20-19-15(21)9-11-3-1-2-4-14(11)18/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyOUEJZPLRZNFYCN-UHFFFAOYSA-N
MW381.20 g/mol
LogP2.36
Rot. Bonds5

About N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide

N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide (PubChem CID 7809057) has the molecular formula C16H14BrFN2O3 and a molecular weight of 381.20 g/mol. Its IUPAC name is N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
PubChem CID7809057
Molecular FormulaC16H14BrFN2O3
Molecular Weight381.20 g/mol
Exact Mass380.02
IUPAC NameN'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
SMILESO=C(COc1ccc(Br)cc1)NNC(=O)Cc1ccccc1F
InChIInChI=1S/C16H14BrFN2O3/c17-12-5-7-13(8-6-12)23-10-16(22)20-19-15(21)9-11-3-1-2-4-14(11)18/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyOUEJZPLRZNFYCN-UHFFFAOYSA-N
XLogP2.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.20
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(3-fluorophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide
CID 2670466
N'-[2-(4-bromophenoxy)acetyl]-3-(2-fluorophenoxy)propanehydrazide
CID 78775232
N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide
CID 7964936
N'-[2-(4-chlorophenoxy)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 26163587
[[2-(4-bromophenoxy)acetyl]amino]thiourea
CID 46706012
N'-[2-(4-bromophenoxy)acetyl]-3-(2-chlorophenyl)propanehydrazide
CID 17179158
N'-[2-(4-methoxyphenoxy)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 26163562
[2-[2-[2-(4-bromophenoxy)acetyl]hydrazinyl]-2-oxoethyl] benzoate
CID 7868379
N'-[2-(4-bromophenoxy)acetyl]-2-[3-(difluoromethoxy)phenyl]acetohydrazide
CID 86897323
N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-2-phenylacetamide
CID 4505092
N-[2-(2-fluorophenyl)ethyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 9199968
N'-[2-(4-bromo-2-fluorophenoxy)acetyl]-2-(4-fluorophenoxy)acetohydrazide
CID 26929895

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The IUPAC name of N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide (CID 7809057) is N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide.
What is the SMILES notation for N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The canonical SMILES for N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide is O=C(COc1ccc(Br)cc1)NNC(=O)Cc1ccccc1F.
What is the InChIKey of N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
The InChIKey is OUEJZPLRZNFYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrFN2O3/c17-12-5-7-13(8-6-12)23-10-16(22)20-19-15(21)9-11-3-1-2-4-14(11)18/h1-8H,9-10H2,(H,19,21)(H,20,22).
What are the key properties of N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide?
N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide has a molecular weight of 381.20 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-bromophenoxy)acetyl]-2-(2-fluorophenyl)acetohydrazide is sourced from PubChem (CID 7809057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).