N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide

C11H10Cl2N2O2 — CID 2193894

IUPACN-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C(=O)NC1CC1
InChIInChI=1S/C11H10Cl2N2O2/c12-8-4-3-7(5-9(8)13)15-11(17)10(16)14-6-1-2-6/h3-6H,1-2H2,(H,14,16)(H,15,17)
InChIKeyFDQJGAOBPGOMNC-UHFFFAOYSA-N
MW273.12 g/mol
LogP2.21
Rot. Bonds2

About N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide

N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide (PubChem CID 2193894) has the molecular formula C11H10Cl2N2O2 and a molecular weight of 273.12 g/mol. Its IUPAC name is N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide.

Molecular Properties

Compound NameN-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide
PubChem CID2193894
Molecular FormulaC11H10Cl2N2O2
Molecular Weight273.12 g/mol
Exact Mass272.01
IUPAC NameN-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C(=O)NC1CC1
InChIInChI=1S/C11H10Cl2N2O2/c12-8-4-3-7(5-9(8)13)15-11(17)10(16)14-6-1-2-6/h3-6H,1-2H2,(H,14,16)(H,15,17)
InChIKeyFDQJGAOBPGOMNC-UHFFFAOYSA-N
XLogP2.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.12
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyl-N'-(3,4-dichlorophenyl)oxamide
CID 2059042
N-cyclohexyl-N'-(3,4-dichlorophenyl)oxamide
CID 2058101
N'-[4-chloro-3-(trifluoromethyl)phenyl]-N-cyclohexyloxamide
CID 108504354
1-(3,4-dichlorophenyl)-3-(4-oxocyclohexyl)urea
CID 43652933
1-(azepan-4-yl)-3-(3,4-dichlorophenyl)urea
CID 107172624
N-cyclopropyl-2-[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylamino]acetamide
CID 31374778
2-N-cyclopentyl-1-N-(3,4-dichlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109132157
N-cyclopropyl-N'-(2,4-dichlorophenyl)oxamide
CID 108502911
1-(3-chloro-4-methylphenyl)-3-cyclopropylurea
CID 6469220
N-cyclohexyl-N'-(3,4-dichlorophenyl)-2,2-dimethylpropanediamide
CID 108959081
N-(3,4-dichlorophenyl)-2-methylprop-2-enamide
CID 16560
1-(3,4-dichlorophenyl)-3-(4-pyrimidin-2-yloxycyclohexyl)urea
CID 90633471

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide?
The IUPAC name of N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide (CID 2193894) is N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide.
What is the SMILES notation for N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide?
The canonical SMILES for N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide is O=C(Nc1ccc(Cl)c(Cl)c1)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide?
The InChIKey is FDQJGAOBPGOMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O2/c12-8-4-3-7(5-9(8)13)15-11(17)10(16)14-6-1-2-6/h3-6H,1-2H2,(H,14,16)(H,15,17).
What are the key properties of N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide?
N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide has a molecular weight of 273.12 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-(3,4-dichlorophenyl)oxamide is sourced from PubChem (CID 2193894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).