4-chloro-2,3-difluorobenzenecarboximidamide

C7H5ClF2N2 — CID 174975357

IUPAC4-chloro-2,3-difluorobenzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(Cl)c(F)c1F
InChIInChI=1S/C7H5ClF2N2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,(H3,11,12)
InChIKeyYZOSYVRQZBUICY-UHFFFAOYSA-N
MW190.58 g/mol
LogP1.90
Rot. Bonds1

About 4-chloro-2,3-difluorobenzenecarboximidamide

4-chloro-2,3-difluorobenzenecarboximidamide (PubChem CID 174975357) has the molecular formula C7H5ClF2N2 and a molecular weight of 190.58 g/mol. Its IUPAC name is 4-chloro-2,3-difluorobenzenecarboximidamide.

Molecular Properties

Compound Name4-chloro-2,3-difluorobenzenecarboximidamide
PubChem CID174975357
Molecular FormulaC7H5ClF2N2
Molecular Weight190.58 g/mol
Exact Mass190.01
IUPAC Name4-chloro-2,3-difluorobenzenecarboximidamide
SMILES[H]/N=C(\N)c1ccc(Cl)c(F)c1F
InChIInChI=1S/C7H5ClF2N2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,(H3,11,12)
InChIKeyYZOSYVRQZBUICY-UHFFFAOYSA-N
XLogP1.90
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.58
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 4-chloro-2,3-difluorobenzenecarboximidamide 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

2-chloro-4-fluorobenzenecarboximidamide
CID 3626359
2-chloro-4,5-difluorobenzenecarboximidamide;ethane
CID 145225974
2-amino-3-chloro-6-fluorobenzenecarboximidamide
CID 57139132
2-bromo-4-(2,5-dichlorophenyl)sulfanyl-3-fluorobenzenecarboximidamide
CID 107537045
5-amino-2,3,4-trifluorobenzenecarboximidamide
CID 83382918
ethyl 4-chloro-2,3-difluorobenzoate
CID 46311295
2-amino-4-fluorobenzenecarboximidamide
CID 140514748
4-chloro-2-(3-chloro-4-fluorophenoxy)benzenecarboximidamide
CID 55257647
4-chloro-2,3-difluoro-N-hydroxybenzenecarboximidoyl chloride
CID 140772331
2-(2-carbamimidoylphenoxy)-3,4-dichlorobenzenecarboximidamide
CID 141195761
2-bromo-4-(3-chloro-4-fluorophenoxy)benzenecarboximidamide
CID 107279626
4-(4-bromo-3-fluorophenoxy)-2-chlorobenzenecarboximidamide
CID 65203810

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2,3-difluorobenzenecarboximidamide?
The IUPAC name of 4-chloro-2,3-difluorobenzenecarboximidamide (CID 174975357) is 4-chloro-2,3-difluorobenzenecarboximidamide.
What is the SMILES notation for 4-chloro-2,3-difluorobenzenecarboximidamide?
The canonical SMILES for 4-chloro-2,3-difluorobenzenecarboximidamide is [H]/N=C(\N)c1ccc(Cl)c(F)c1F.
What is the InChIKey of 4-chloro-2,3-difluorobenzenecarboximidamide?
The InChIKey is YZOSYVRQZBUICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClF2N2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,(H3,11,12).
What are the key properties of 4-chloro-2,3-difluorobenzenecarboximidamide?
4-chloro-2,3-difluorobenzenecarboximidamide has a molecular weight of 190.58 g/mol, XLogP of 1.90, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2,3-difluorobenzenecarboximidamide is sourced from PubChem (CID 174975357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).