1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide

C11H10F2N2O2 — CID 175093639

IUPAC1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide
SMILESNC(=O)C1(C(=O)Nc2ccc(F)cc2F)CC1
InChIInChI=1S/C11H10F2N2O2/c12-6-1-2-8(7(13)5-6)15-10(17)11(3-4-11)9(14)16/h1-2,5H,3-4H2,(H2,14,16)(H,15,17)
InChIKeyOIBHZHWYAGLAGM-UHFFFAOYSA-N
MW240.21 g/mol
LogP1.17
Rot. Bonds3

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

1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide (PubChem CID 175093639) has the molecular formula C11H10F2N2O2 and a molecular weight of 240.21 g/mol. Its IUPAC name is 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide.

Molecular Properties

Compound Name1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide
PubChem CID175093639
Molecular FormulaC11H10F2N2O2
Molecular Weight240.21 g/mol
Exact Mass240.07
IUPAC Name1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide
SMILESNC(=O)C1(C(=O)Nc2ccc(F)cc2F)CC1
InChIInChI=1S/C11H10F2N2O2/c12-6-1-2-8(7(13)5-6)15-10(17)11(3-4-11)9(14)16/h1-2,5H,3-4H2,(H2,14,16)(H,15,17)
InChIKeyOIBHZHWYAGLAGM-UHFFFAOYSA-N
XLogP1.17
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

1-N-(2,4-difluorophenyl)-1-N'-(2-methylphenyl)cyclopropane-1,1-dicarboxamide
CID 108980715
1-N'-(2,4-difluorophenyl)-1-N-propylcyclopropane-1,1-dicarboxamide
CID 108970362
1-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
CID 58987988
4-[(2,4-difluorophenyl)carbamoyl]oxane-4-carboxylic acid
CID 154865208
1-N'-(2,4-difluorophenyl)-1-N-(3,4-dimethylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981437
1-(aminomethyl)-N-(2,4-difluorophenyl)cyclobutane-1-carboxamide
CID 80586877
1-N-(2,4-difluorophenyl)-1-N',1-N'-dipropylcyclopropane-1,1-dicarboxamide
CID 108980321
1-N-(2,4-difluorophenyl)-1-N'-methyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108981020
ethane;1-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide
CID 142389923
1-carbamothioyl-N-(4-fluoro-2-methylphenyl)cyclopropane-1-carboxamide
CID 80593248
1-N'-(2,4-difluorophenyl)-1-N-[(3,4-dimethoxyphenyl)methyl]cyclopropane-1,1-dicarboxamide
CID 108978471
1-N'-(2,4-difluorophenyl)-1-N-(4-propan-2-yloxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108983273

Frequently Asked Questions

What is the IUPAC name of 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide?
The IUPAC name of 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide (CID 175093639) is 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide.
What is the SMILES notation for 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide?
The canonical SMILES for 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide is NC(=O)C1(C(=O)Nc2ccc(F)cc2F)CC1.
What is the InChIKey of 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide?
The InChIKey is OIBHZHWYAGLAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2O2/c12-6-1-2-8(7(13)5-6)15-10(17)11(3-4-11)9(14)16/h1-2,5H,3-4H2,(H2,14,16)(H,15,17).
What are the key properties of 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide?
1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide has a molecular weight of 240.21 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-(2,4-difluorophenyl)cyclopropane-1,1-dicarboxamide is sourced from PubChem (CID 175093639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).