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

C19H18Cl2N2O2 — CID 108981521

IUPAC1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide
SMILESCc1cc(C)cc(NC(=O)C2(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)c1
InChIInChI=1S/C19H18Cl2N2O2/c1-11-5-12(2)7-15(6-11)22-17(24)19(3-4-19)18(25)23-16-9-13(20)8-14(21)10-16/h5-10H,3-4H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyNZIVDDAHYUTMEW-UHFFFAOYSA-N
MW377.27 g/mol
LogP4.97
Rot. Bonds4

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

1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide (PubChem CID 108981521) has the molecular formula C19H18Cl2N2O2 and a molecular weight of 377.27 g/mol. Its IUPAC name is 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide.

Molecular Properties

Compound Name1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide
PubChem CID108981521
Molecular FormulaC19H18Cl2N2O2
Molecular Weight377.27 g/mol
Exact Mass376.07
IUPAC Name1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide
SMILESCc1cc(C)cc(NC(=O)C2(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)c1
InChIInChI=1S/C19H18Cl2N2O2/c1-11-5-12(2)7-15(6-11)22-17(24)19(3-4-19)18(25)23-16-9-13(20)8-14(21)10-16/h5-10H,3-4H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyNZIVDDAHYUTMEW-UHFFFAOYSA-N
XLogP4.97
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 ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

1-N-(4-chlorophenyl)-1-N'-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981473
1-carbamothioyl-N-(3,5-dichlorophenyl)cyclopropane-1-carboxamide
CID 80591867
1-N'-(3,5-dimethylphenyl)-1-N-(4-ethylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981461
N-(3,5-dichlorophenyl)-1-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 108971734
ethyl 1-[(3,5-dichlorophenyl)carbamoyl]cyclobutane-1-carboxylate
CID 19096840
1-N'-(3,5-dimethylphenyl)-1-N-(4-pyrrolidin-1-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981505
1-amino-N-(3,5-dimethylphenyl)cyclopropane-1-carboxamide
CID 65465042
1-N'-(3,5-dimethylphenyl)-1-N-(4-piperidin-1-ylphenyl)cyclopropane-1,1-dicarboxamide
CID 108981506
N-(3,5-dichlorophenyl)-1-(4-ethylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 108974230
1-N'-(3,5-dimethylphenyl)-1-N-[(2-methylphenyl)methyl]cyclopropane-1,1-dicarboxamide
CID 108974966
1-N'-(3-chloro-4-fluorophenyl)-1-N-(4-methylphenyl)cyclopropane-1,1-dicarboxamide
CID 108980871
N-(3,5-dimethylphenyl)-1-(morpholine-4-carbonyl)cyclopropane-1-carboxamide
CID 108973117

Frequently Asked Questions

What is the IUPAC name of 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide?
The IUPAC name of 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide (CID 108981521) is 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide.
What is the SMILES notation for 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide?
The canonical SMILES for 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide is Cc1cc(C)cc(NC(=O)C2(C(=O)Nc3cc(Cl)cc(Cl)c3)CC2)c1.
What is the InChIKey of 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide?
The InChIKey is NZIVDDAHYUTMEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O2/c1-11-5-12(2)7-15(6-11)22-17(24)19(3-4-19)18(25)23-16-9-13(20)8-14(21)10-16/h5-10H,3-4H2,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide?
1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide has a molecular weight of 377.27 g/mol, XLogP of 4.97, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-(3,5-dichlorophenyl)-1-N-(3,5-dimethylphenyl)cyclopropane-1,1-dicarboxamide is sourced from PubChem (CID 108981521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).