2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide

C17H14BrFN2O2 — CID 109142656

IUPAC2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccc(Br)cc1)C1CC1C(=O)Nc1ccccc1F
InChIInChI=1S/C17H14BrFN2O2/c18-10-5-7-11(8-6-10)20-16(22)12-9-13(12)17(23)21-15-4-2-1-3-14(15)19/h1-8,12-13H,9H2,(H,20,22)(H,21,23)
InChIKeyMRVODHIXWYDUJV-UHFFFAOYSA-N
MW377.21 g/mol
LogP3.80
Rot. Bonds4

About 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide

2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109142656) has the molecular formula C17H14BrFN2O2 and a molecular weight of 377.21 g/mol. Its IUPAC name is 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109142656
Molecular FormulaC17H14BrFN2O2
Molecular Weight377.21 g/mol
Exact Mass376.02
IUPAC Name2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide
SMILESO=C(Nc1ccc(Br)cc1)C1CC1C(=O)Nc1ccccc1F
InChIInChI=1S/C17H14BrFN2O2/c18-10-5-7-11(8-6-10)20-16(22)12-9-13(12)17(23)21-15-4-2-1-3-14(15)19/h1-8,12-13H,9H2,(H,20,22)(H,21,23)
InChIKeyMRVODHIXWYDUJV-UHFFFAOYSA-N
XLogP3.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.21
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(2-fluorophenyl)-2-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141026
2-N-(4-bromophenyl)-1-N-(2-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109143302
1-N-(2-fluorophenyl)-2-N-[(2-fluorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109135951
2-N-benzyl-1-N-(4-bromophenyl)cyclopropane-1,2-dicarboxamide
CID 109135067
trans-ethyl (1S,2S)-2-[(2-fluorophenyl)carbamoyl]cyclopropane-1-carboxylate
CID 178138593
1-N-(2-fluorophenyl)-2-N-(2-methylpropyl)cyclopropane-1,2-dicarboxamide
CID 109131515
2-N-(4-bromophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141603
2-N-(4-chlorophenyl)-1-N-(2-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109140926
2-(4-acetylpiperazine-1-carbonyl)-N-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 109134727
N-(4-bromophenyl)-2-(2-fluoroanilino)-4,5-dihydro-1,3-thiazole-4-carboxamide
CID 71169205
2-N-(3-bromophenyl)-1-N-(2,6-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144039
N-(2-fluorophenyl)-2-(4-methylpiperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109132656

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide (CID 109142656) is 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide is O=C(Nc1ccc(Br)cc1)C1CC1C(=O)Nc1ccccc1F.
What is the InChIKey of 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is MRVODHIXWYDUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrFN2O2/c18-10-5-7-11(8-6-10)20-16(22)12-9-13(12)17(23)21-15-4-2-1-3-14(15)19/h1-8,12-13H,9H2,(H,20,22)(H,21,23).
What are the key properties of 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide?
2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 377.21 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-bromophenyl)-1-N-(2-fluorophenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109142656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).