2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide

C18H13Cl2N3O2 — CID 109144193

IUPAC2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide
SMILESN#Cc1ccc(NC(=O)C2CC2C(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C18H13Cl2N3O2/c19-14-2-1-3-15(16(14)20)23-18(25)13-8-12(13)17(24)22-11-6-4-10(9-21)5-7-11/h1-7,12-13H,8H2,(H,22,24)(H,23,25)
InChIKeyCNOJXSDXRAKPES-UHFFFAOYSA-N
MW374.23 g/mol
LogP4.08
Rot. Bonds4

About 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide

2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109144193) has the molecular formula C18H13Cl2N3O2 and a molecular weight of 374.23 g/mol. Its IUPAC name is 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109144193
Molecular FormulaC18H13Cl2N3O2
Molecular Weight374.23 g/mol
Exact Mass373.04
IUPAC Name2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide
SMILESN#Cc1ccc(NC(=O)C2CC2C(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C18H13Cl2N3O2/c19-14-2-1-3-15(16(14)20)23-18(25)13-8-12(13)17(24)22-11-6-4-10(9-21)5-7-11/h1-7,12-13H,8H2,(H,22,24)(H,23,25)
InChIKeyCNOJXSDXRAKPES-UHFFFAOYSA-N
XLogP4.08
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.23
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2R)-1-N,2-N-bis(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 124628395
1-N-(2,3-dichlorophenyl)-2-N-(4-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143544
1-N-(3-chloro-4-fluorophenyl)-2-N-(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109143222
1-N-(3-bromophenyl)-2-N-(4-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109144038
4-cyano-N-(2,3-dichlorophenyl)benzamide
CID 23761721
2-N-(4-tert-butylphenyl)-1-N-(2-chlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109142602
1-N-(2-chlorophenyl)-2-N-(4-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109142354
N-(2,3-dichlorophenyl)cyclopropanecarboxamide
CID 4652086
N'-(2-chlorophenyl)-N-(4-cyanophenyl)oxamide
CID 108500274
1-N-(2-chlorophenyl)-2-N-(3,4-dichlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109142847
2-N-(4-bromophenyl)-1-N-(2-cyanophenyl)cyclopropane-1,2-dicarboxamide
CID 109143302
1-N-(4-cyanophenyl)-4-N-(2-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150405

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide (CID 109144193) is 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide is N#Cc1ccc(NC(=O)C2CC2C(=O)Nc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is CNOJXSDXRAKPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O2/c19-14-2-1-3-15(16(14)20)23-18(25)13-8-12(13)17(24)22-11-6-4-10(9-21)5-7-11/h1-7,12-13H,8H2,(H,22,24)(H,23,25).
What are the key properties of 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide?
2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 374.23 g/mol, XLogP of 4.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-cyanophenyl)-1-N-(2,3-dichlorophenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109144193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).