1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide

C19H18Cl2N2O3 — CID 109136513

IUPAC1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
SMILESCOc1ccccc1CNC(=O)C1CC1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C19H18Cl2N2O3/c1-26-16-8-3-2-5-11(16)10-22-18(24)12-9-13(12)19(25)23-15-7-4-6-14(20)17(15)21/h2-8,12-13H,9-10H2,1H3,(H,22,24)(H,23,25)
InChIKeyYQGZTNLRHAMCTF-UHFFFAOYSA-N
MW393.27 g/mol
LogP3.89
Rot. Bonds6

About 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide

1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide (PubChem CID 109136513) has the molecular formula C19H18Cl2N2O3 and a molecular weight of 393.27 g/mol. Its IUPAC name is 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
PubChem CID109136513
Molecular FormulaC19H18Cl2N2O3
Molecular Weight393.27 g/mol
Exact Mass392.07
IUPAC Name1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
SMILESCOc1ccccc1CNC(=O)C1CC1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C19H18Cl2N2O3/c1-26-16-8-3-2-5-11(16)10-22-18(24)12-9-13(12)19(25)23-15-7-4-6-14(20)17(15)21/h2-8,12-13H,9-10H2,1H3,(H,22,24)(H,23,25)
InChIKeyYQGZTNLRHAMCTF-UHFFFAOYSA-N
XLogP3.89
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 ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(2,5-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136510
1-N-(4-acetamidophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136494
1-N-(3-chloro-2-methylphenyl)-2-N-[2-(2-methoxyphenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109137850
2-N-[(2-chlorophenyl)methyl]-1-N-(2-methoxy-5-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109136241
1-N-(2,4-difluorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136506
1-(2,3-dichlorophenyl)-3-[(2-methoxyphenyl)methyl]thiourea
CID 19649544
2-N-(2-methoxyethyl)-1-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109132921
2-N-[(2-methoxyphenyl)methyl]-1-N-[4-(trifluoromethyl)phenyl]cyclopropane-1,2-dicarboxamide
CID 109136490
N-(2,3-dichlorophenyl)-3-(2-methoxyphenyl)propanamide
CID 26694107
1-N-(2,3-dichlorophenyl)-2-N-(3-phenylpropyl)cyclopropane-1,2-dicarboxamide
CID 109139494
1-N-(2,3-dichlorophenyl)-2-N-[2-(4-fluorophenyl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109137792
1-N-(2-methoxyphenyl)-2-N-(2-methylpropyl)cyclopropane-1,2-dicarboxamide
CID 109131530

Frequently Asked Questions

What is the IUPAC name of 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide (CID 109136513) is 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide is COc1ccccc1CNC(=O)C1CC1C(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide?
The InChIKey is YQGZTNLRHAMCTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O3/c1-26-16-8-3-2-5-11(16)10-22-18(24)12-9-13(12)19(25)23-15-7-4-6-14(20)17(15)21/h2-8,12-13H,9-10H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide?
1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide has a molecular weight of 393.27 g/mol, XLogP of 3.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2,3-dichlorophenyl)-2-N-[(2-methoxyphenyl)methyl]cyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109136513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).