[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine

C15H14Cl2F2N2 — CID 105206757

IUPAC[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2F2N2/c16-11-2-1-10(15(17)7-11)6-14(21-20)5-9-3-12(18)8-13(19)4-9/h1-4,7-8,14,21H,5-6,20H2
InChIKeyQDCVKHNOJAZPJV-UHFFFAOYSA-N
MW331.19 g/mol
LogP3.89
Rot. Bonds5

About [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine

[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine (PubChem CID 105206757) has the molecular formula C15H14Cl2F2N2 and a molecular weight of 331.19 g/mol. Its IUPAC name is [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine
PubChem CID105206757
Molecular FormulaC15H14Cl2F2N2
Molecular Weight331.19 g/mol
Exact Mass330.05
IUPAC Name[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)Cc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2F2N2/c16-11-2-1-10(15(17)7-11)6-14(21-20)5-9-3-12(18)8-13(19)4-9/h1-4,7-8,14,21H,5-6,20H2
InChIKeyQDCVKHNOJAZPJV-UHFFFAOYSA-N
XLogP3.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.19
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine (CID 105206757) is [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine is NNC(Cc1cc(F)cc(F)c1)Cc1ccc(Cl)cc1Cl.
What is the InChIKey of [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine?
The InChIKey is QDCVKHNOJAZPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2F2N2/c16-11-2-1-10(15(17)7-11)6-14(21-20)5-9-3-12(18)8-13(19)4-9/h1-4,7-8,14,21H,5-6,20H2.
What are the key properties of [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine?
[1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine has a molecular weight of 331.19 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dichlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105206757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).