2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide

C15H13F2N3O3 — CID 109144128

IUPAC2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
SMILESCc1cc(NC(=O)C2CC2C(=O)Nc2ccc(F)cc2F)no1
InChIInChI=1S/C15H13F2N3O3/c1-7-4-13(20-23-7)19-15(22)10-6-9(10)14(21)18-12-3-2-8(16)5-11(12)17/h2-5,9-10H,6H2,1H3,(H,18,21)(H,19,20,22)
InChIKeyQTLAWZZWJVTEDE-UHFFFAOYSA-N
MW321.28 g/mol
LogP2.47
Rot. Bonds4

About 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide

2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide (PubChem CID 109144128) has the molecular formula C15H13F2N3O3 and a molecular weight of 321.28 g/mol. Its IUPAC name is 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
PubChem CID109144128
Molecular FormulaC15H13F2N3O3
Molecular Weight321.28 g/mol
Exact Mass321.09
IUPAC Name2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
SMILESCc1cc(NC(=O)C2CC2C(=O)Nc2ccc(F)cc2F)no1
InChIInChI=1S/C15H13F2N3O3/c1-7-4-13(20-23-7)19-15(22)10-6-9(10)14(21)18-12-3-2-8(16)5-11(12)17/h2-5,9-10H,6H2,1H3,(H,18,21)(H,19,20,22)
InChIKeyQTLAWZZWJVTEDE-UHFFFAOYSA-N
XLogP2.47
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.28
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N,2-N-bis(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144111
2-N-[4-(diethylamino)-2-methylphenyl]-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
CID 109144211
1-N-(2,4-difluorophenyl)-2-N-(3,4-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141721
2-N-(2,4-difluorophenyl)-6-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,6-dicarboxamide
CID 109101087
1-N-(5-methyl-1,2-oxazol-3-yl)-2-N-(2-phenoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109144136
1-N-tert-butyl-2-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
CID 109139692
2-N-cyclopropyl-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide
CID 109131011
1-N-(2,4-difluorophenyl)-2-N-(4-ethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142120
2-N-(4-acetylphenyl)-1-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109143805
2-N-(3,4-dichlorophenyl)-1-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144113
1-N-(2,5-dichlorophenyl)-2-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144115
1-N-(2,4-difluorophenyl)-2-N-(4-propan-2-yloxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143638

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide (CID 109144128) is 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide is Cc1cc(NC(=O)C2CC2C(=O)Nc2ccc(F)cc2F)no1.
What is the InChIKey of 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide?
The InChIKey is QTLAWZZWJVTEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N3O3/c1-7-4-13(20-23-7)19-15(22)10-6-9(10)14(21)18-12-3-2-8(16)5-11(12)17/h2-5,9-10H,6H2,1H3,(H,18,21)(H,19,20,22).
What are the key properties of 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide?
2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide has a molecular weight of 321.28 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,4-difluorophenyl)-1-N-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109144128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).