2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide

C20H20Cl2N2O2 — CID 109136180

IUPAC2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)C1CC1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C20H20Cl2N2O2/c21-15-7-5-13(6-8-15)9-10-23-19(25)16-11-17(16)20(26)24-12-14-3-1-2-4-18(14)22/h1-8,16-17H,9-12H2,(H,23,25)(H,24,26)
InChIKeyLETZMLCQSFNPFM-UHFFFAOYSA-N
MW391.30 g/mol
LogP3.60
Rot. Bonds7

About 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide

2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide (PubChem CID 109136180) has the molecular formula C20H20Cl2N2O2 and a molecular weight of 391.30 g/mol. Its IUPAC name is 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide
PubChem CID109136180
Molecular FormulaC20H20Cl2N2O2
Molecular Weight391.30 g/mol
Exact Mass390.09
IUPAC Name2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)C1CC1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C20H20Cl2N2O2/c21-15-7-5-13(6-8-15)9-10-23-19(25)16-11-17(16)20(26)24-12-14-3-1-2-4-18(14)22/h1-8,16-17H,9-12H2,(H,23,25)(H,24,26)
InChIKeyLETZMLCQSFNPFM-UHFFFAOYSA-N
XLogP3.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.30
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130448
N-[2-(4-chlorophenyl)ethyl]-N'-[(2-chlorophenyl)methyl]oxamide
CID 18588832
2-N-[2-(4-chlorophenyl)ethyl]-1-N-[2-(dimethylamino)ethyl]cyclopropane-1,2-dicarboxamide
CID 109133673
2-N-[(2-chlorophenyl)methyl]-1-N-(2-methylpropyl)cyclopropane-1,2-dicarboxamide
CID 109131432
2-N-[(2-chlorophenyl)methyl]-1-N-(3,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109136278
(3R,4R)-3-N,4-N-bis[2-(4-chlorophenyl)ethyl]pyrrolidine-3,4-dicarboxamide
CID 154961412
1-N,4-N-bis[2-(4-chlorophenyl)ethyl]cyclohexane-1,4-dicarboxamide
CID 26644708
2-N-[2-(3-chlorophenyl)ethyl]-1-N-[2-(2-fluorophenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109137606
N-[(2-chlorophenyl)methyl]cyclopropanecarboxamide
CID 899098
1-[(2-chlorophenyl)methyl]-3-[2-(4-methylphenyl)ethyl]urea
CID 108891006
2-[(4-chlorophenyl)methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 60791872
1-N-(4-acetylphenyl)-2-N-[2-(4-chlorophenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109138655

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide (CID 109136180) is 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide is O=C(NCCc1ccc(Cl)cc1)C1CC1C(=O)NCc1ccccc1Cl.
What is the InChIKey of 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide?
The InChIKey is LETZMLCQSFNPFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Cl2N2O2/c21-15-7-5-13(6-8-15)9-10-23-19(25)16-11-17(16)20(26)24-12-14-3-1-2-4-18(14)22/h1-8,16-17H,9-12H2,(H,23,25)(H,24,26).
What are the key properties of 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide?
2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide has a molecular weight of 391.30 g/mol, XLogP of 3.60, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109136180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).