N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide

C12H13ClN2O3 — CID 2194402

IUPACN'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(=O)NC1CC1
InChIInChI=1S/C12H13ClN2O3/c1-18-10-5-2-7(13)6-9(10)15-12(17)11(16)14-8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,14,16)(H,15,17)
InChIKeyHICLZRZXAYOHFE-UHFFFAOYSA-N
MW268.70 g/mol
LogP1.57
Rot. Bonds3

About N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide

N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide (PubChem CID 2194402) has the molecular formula C12H13ClN2O3 and a molecular weight of 268.70 g/mol. Its IUPAC name is N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide.

Molecular Properties

Compound NameN'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide
PubChem CID2194402
Molecular FormulaC12H13ClN2O3
Molecular Weight268.70 g/mol
Exact Mass268.06
IUPAC NameN'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(=O)NC1CC1
InChIInChI=1S/C12H13ClN2O3/c1-18-10-5-2-7(13)6-9(10)15-12(17)11(16)14-8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,14,16)(H,15,17)
InChIKeyHICLZRZXAYOHFE-UHFFFAOYSA-N
XLogP1.57
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502302
1-(5-chloro-2-methoxyphenyl)-3-cyclododecylurea
CID 108875500
2-(5-chloro-2-methoxyanilino)-2-oxoacetate
CID 2300901
N-cyclopropyl-N'-(2,4-dichlorophenyl)oxamide
CID 108502911
N'-(5-chloro-2-methoxyphenyl)-N-(3,4-dimethoxyphenyl)oxamide
CID 45000696
N'-(4-chloro-2,5-dimethoxyphenyl)-N-cycloheptyloxamide
CID 108530972
2-(5-chloro-2-methoxyanilino)-N-cyclohexylpropanamide
CID 43083885
N'-(5-chloro-2-methoxyphenyl)-N-(2,4-difluorophenyl)oxamide
CID 108502324
N-(5-chloro-2-methoxyphenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108502213
2-N-(5-chloro-2-methoxyphenyl)-6-N-cyclopentylpyridine-2,6-dicarboxamide
CID 109095044
3-[[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]amino]-N-cyclopropyl-4-methylbenzamide
CID 60536487
4-[(5-chloro-2-methoxyphenyl)carbamoylamino]-N-cyclopentylbenzamide
CID 17180685

Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide?
The IUPAC name of N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide (CID 2194402) is N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide.
What is the SMILES notation for N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide?
The canonical SMILES for N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide is COc1ccc(Cl)cc1NC(=O)C(=O)NC1CC1.
What is the InChIKey of N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide?
The InChIKey is HICLZRZXAYOHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O3/c1-18-10-5-2-7(13)6-9(10)15-12(17)11(16)14-8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide?
N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide has a molecular weight of 268.70 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide is sourced from PubChem (CID 2194402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).