N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide

C10H10FN3O2 — CID 20798668

IUPACN'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide
SMILESCOc1cc(NNC(C)=O)c(F)cc1C#N
InChIInChI=1S/C10H10FN3O2/c1-6(15)13-14-9-4-10(16-2)7(5-12)3-8(9)11/h3-4,14H,1-2H3,(H,13,15)
InChIKeyODZWGYTZVCXWMQ-UHFFFAOYSA-N
MW223.21 g/mol
LogP1.17
Rot. Bonds3

About N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide

N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide (PubChem CID 20798668) has the molecular formula C10H10FN3O2 and a molecular weight of 223.21 g/mol. Its IUPAC name is N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide.

Molecular Properties

Compound NameN'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide
PubChem CID20798668
Molecular FormulaC10H10FN3O2
Molecular Weight223.21 g/mol
Exact Mass223.08
IUPAC NameN'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide
SMILESCOc1cc(NNC(C)=O)c(F)cc1C#N
InChIInChI=1S/C10H10FN3O2/c1-6(15)13-14-9-4-10(16-2)7(5-12)3-8(9)11/h3-4,14H,1-2H3,(H,13,15)
InChIKeyODZWGYTZVCXWMQ-UHFFFAOYSA-N
XLogP1.17
TPSA74.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.21
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-cyano-2-fluoro-5-methoxyphenyl)-2-pentoxyacetamide
CID 126832694
5-fluoro-2,4-dimethoxybenzoic acid;5-fluoro-2,4-dimethoxybenzonitrile
CID 159510028
N-(3-cyano-4-methoxyphenyl)acetamide
CID 5070081
5-fluoro-2-methoxy-4-nitrobenzonitrile
CID 166638353
methyl 5-cyano-2-(difluoromethyl)-4-methoxybenzoate
CID 134646962
ethyl (E)-3-[(E)-[(4-cyano-2-fluoro-5-methoxyphenyl)hydrazinylidene]methyl]-4,4,4-trifluorobut-2-enoate
CID 11199164
4-(cyanomethyl)-5-fluoro-2-methoxybenzonitrile
CID 171031195
ethyl N-[4-cyano-2-fluoro-5-(4-methoxyphenoxy)phenyl]carbamate
CID 22642510
4-cyano-5-fluoro-2-methoxybenzoic acid
CID 131092344
4-acetyl-2-fluoro-6-methoxybenzonitrile
CID 131590815
4-cyano-3-methoxybenzoyl chloride
CID 45081742
5-cyano-4-fluoro-2-methoxybenzoyl chloride
CID 171021975

Frequently Asked Questions

What is the IUPAC name of N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide?
The IUPAC name of N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide (CID 20798668) is N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide.
What is the SMILES notation for N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide?
The canonical SMILES for N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide is COc1cc(NNC(C)=O)c(F)cc1C#N.
What is the InChIKey of N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide?
The InChIKey is ODZWGYTZVCXWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O2/c1-6(15)13-14-9-4-10(16-2)7(5-12)3-8(9)11/h3-4,14H,1-2H3,(H,13,15).
What are the key properties of N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide?
N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide has a molecular weight of 223.21 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-cyano-2-fluoro-5-methoxyphenyl)acetohydrazide is sourced from PubChem (CID 20798668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).