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

C19H18Cl2N2O3 — CID 109143497

IUPAC2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
SMILESCCOc1ccccc1NC(=O)C1CC1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H18Cl2N2O3/c1-2-26-17-6-4-3-5-16(17)23-19(25)13-10-12(13)18(24)22-11-7-8-14(20)15(21)9-11/h3-9,12-13H,2,10H2,1H3,(H,22,24)(H,23,25)
InChIKeyDEUDLRHCEWMUHF-UHFFFAOYSA-N
MW393.27 g/mol
LogP4.61
Rot. Bonds6

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

2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide (PubChem CID 109143497) has the molecular formula C19H18Cl2N2O3 and a molecular weight of 393.27 g/mol. Its IUPAC name is 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
PubChem CID109143497
Molecular FormulaC19H18Cl2N2O3
Molecular Weight393.27 g/mol
Exact Mass392.07
IUPAC Name2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
SMILESCCOc1ccccc1NC(=O)C1CC1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H18Cl2N2O3/c1-2-26-17-6-4-3-5-16(17)23-19(25)13-10-12(13)18(24)22-11-7-8-14(20)15(21)9-11/h3-9,12-13H,2,10H2,1H3,(H,22,24)(H,23,25)
InChIKeyDEUDLRHCEWMUHF-UHFFFAOYSA-N
XLogP4.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.27
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(3-chlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142878
1-N-(2-ethoxyphenyl)-2-N-(3-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141044
1-N-(2-chlorophenyl)-2-N-(3,4-dichlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109142847
1-N-tert-butyl-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109139628
2-N-cyclopentyl-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109132110
1-N-(2,6-difluorophenyl)-2-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143509
1-N-(2,3-dichlorophenyl)-2-N-(4-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143544
1-(2-butoxyphenyl)-3-(3,4-dichlorophenyl)urea
CID 19187559
1-N-(2-ethoxyphenyl)-2-N-[(4-fluorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136109
2-N-(3,4-dichlorophenyl)-1-N-(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144113
1-N-(3,5-dichlorophenyl)-2-N-(2-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143352
2-N-(3,4-dichlorophenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141641

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide (CID 109143497) is 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide is CCOc1ccccc1NC(=O)C1CC1C(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
The InChIKey is DEUDLRHCEWMUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O3/c1-2-26-17-6-4-3-5-16(17)23-19(25)13-10-12(13)18(24)22-11-7-8-14(20)15(21)9-11/h3-9,12-13H,2,10H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide?
2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide has a molecular weight of 393.27 g/mol, XLogP of 4.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,4-dichlorophenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109143497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).