1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide

C17H12Cl2F2N2O2 — CID 109144115

IUPAC1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CC1C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C17H12Cl2F2N2O2/c18-8-1-3-12(19)15(5-8)23-17(25)11-7-10(11)16(24)22-14-4-2-9(20)6-13(14)21/h1-6,10-11H,7H2,(H,22,24)(H,23,25)
InChIKeyFJFCWONDBXZMDE-UHFFFAOYSA-N
MW385.20 g/mol
LogP4.48
Rot. Bonds4

About 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide

1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109144115) has the molecular formula C17H12Cl2F2N2O2 and a molecular weight of 385.20 g/mol. Its IUPAC name is 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109144115
Molecular FormulaC17H12Cl2F2N2O2
Molecular Weight385.20 g/mol
Exact Mass384.02
IUPAC Name1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CC1C(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C17H12Cl2F2N2O2/c18-8-1-3-12(19)15(5-8)23-17(25)11-7-10(11)16(24)22-14-4-2-9(20)6-13(14)21/h1-6,10-11H,7H2,(H,22,24)(H,23,25)
InChIKeyFJFCWONDBXZMDE-UHFFFAOYSA-N
XLogP4.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.20
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide (CID 109144115) is 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide is O=C(Nc1ccc(F)cc1F)C1CC1C(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is FJFCWONDBXZMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2F2N2O2/c18-8-1-3-12(19)15(5-8)23-17(25)11-7-10(11)16(24)22-14-4-2-9(20)6-13(14)21/h1-6,10-11H,7H2,(H,22,24)(H,23,25).
What are the key properties of 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide?
1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 385.20 g/mol, XLogP of 4.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109144115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).