(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine

C10H10Cl2FNO — CID 121215981

IUPAC(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine
SMILESCO/N=C(\CF)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H10Cl2FNO/c1-15-14-9(6-13)4-7-2-3-8(11)5-10(7)12/h2-3,5H,4,6H2,1H3/b14-9-
InChIKeyQIRDAEVKTDGLOL-ZROIWOOFSA-N
MW250.10 g/mol
LogP3.51
Rot. Bonds4

About (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine

(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine (PubChem CID 121215981) has the molecular formula C10H10Cl2FNO and a molecular weight of 250.10 g/mol. Its IUPAC name is (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine.

Molecular Properties

Compound Name(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine
PubChem CID121215981
Molecular FormulaC10H10Cl2FNO
Molecular Weight250.10 g/mol
Exact Mass249.01
IUPAC Name(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine
SMILESCO/N=C(\CF)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C10H10Cl2FNO/c1-15-14-9(6-13)4-7-2-3-8(11)5-10(7)12/h2-3,5H,4,6H2,1H3/b14-9-
InChIKeyQIRDAEVKTDGLOL-ZROIWOOFSA-N
XLogP3.51
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.10
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine?
The IUPAC name of (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine (CID 121215981) is (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine.
What is the SMILES notation for (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine?
The canonical SMILES for (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine is CO/N=C(\CF)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine?
The InChIKey is QIRDAEVKTDGLOL-ZROIWOOFSA-N. The full InChI is InChI=1S/C10H10Cl2FNO/c1-15-14-9(6-13)4-7-2-3-8(11)5-10(7)12/h2-3,5H,4,6H2,1H3/b14-9-.
What are the key properties of (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine?
(Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine has a molecular weight of 250.10 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(2,4-dichlorophenyl)-3-fluoro-N-methoxypropan-2-imine is sourced from PubChem (CID 121215981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).