2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide

C19H18Cl2N2O2 — CID 109141641

IUPAC2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCc1ccc(C)c(NC(=O)C2CC2C(=O)Nc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C19H18Cl2N2O2/c1-10-3-4-11(2)17(7-10)23-19(25)14-9-13(14)18(24)22-12-5-6-15(20)16(21)8-12/h3-8,13-14H,9H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyMEKBVJCZPCRQQG-UHFFFAOYSA-N
MW377.27 g/mol
LogP4.82
Rot. Bonds4

About 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide

2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109141641) has the molecular formula C19H18Cl2N2O2 and a molecular weight of 377.27 g/mol. Its IUPAC name is 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109141641
Molecular FormulaC19H18Cl2N2O2
Molecular Weight377.27 g/mol
Exact Mass376.07
IUPAC Name2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
SMILESCc1ccc(C)c(NC(=O)C2CC2C(=O)Nc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C19H18Cl2N2O2/c1-10-3-4-11(2)17(7-10)23-19(25)14-9-13(14)18(24)22-12-5-6-15(20)16(21)8-12/h3-8,13-14H,9H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyMEKBVJCZPCRQQG-UHFFFAOYSA-N
XLogP4.82
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.27
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide (CID 109141641) is 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide is Cc1ccc(C)c(NC(=O)C2CC2C(=O)Nc2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is MEKBVJCZPCRQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O2/c1-10-3-4-11(2)17(7-10)23-19(25)14-9-13(14)18(24)22-12-5-6-15(20)16(21)8-12/h3-8,13-14H,9H2,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide?
2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 377.27 g/mol, XLogP of 4.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109141641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).