2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide

C18H19N3O4 — CID 7199369

IUPAC2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide
SMILESCc1ccc(NC(=O)NC(=O)COc2ccccc2C(N)=O)c(C)c1
InChIInChI=1S/C18H19N3O4/c1-11-7-8-14(12(2)9-11)20-18(24)21-16(22)10-25-15-6-4-3-5-13(15)17(19)23/h3-9H,10H2,1-2H3,(H2,19,23)(H2,20,21,22,24)
InChIKeyXNYCUWCCHLGVRT-UHFFFAOYSA-N
MW341.37 g/mol
LogP2.13
Rot. Bonds5

About 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide

2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide (PubChem CID 7199369) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide
PubChem CID7199369
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide
SMILESCc1ccc(NC(=O)NC(=O)COc2ccccc2C(N)=O)c(C)c1
InChIInChI=1S/C18H19N3O4/c1-11-7-8-14(12(2)9-11)20-18(24)21-16(22)10-25-15-6-4-3-5-13(15)17(19)23/h3-9H,10H2,1-2H3,(H2,19,23)(H2,20,21,22,24)
InChIKeyXNYCUWCCHLGVRT-UHFFFAOYSA-N
XLogP2.13
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetylphenoxy)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide
CID 112781528
N-[(2,4-dimethylphenyl)carbamoyl]-2-(2-iodophenoxy)acetamide
CID 38879134
[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 2-iodobenzoate
CID 2509396
2-(2,4-dichlorophenoxy)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide
CID 2500686
2-(2,4-dibromophenoxy)-N-[(2,4-dimethylphenyl)carbamoyl]acetamide
CID 2632532
[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 3-(2-ethoxyphenyl)propanoate
CID 7578048
N-[(2,4-dimethylphenyl)carbamothioyl]-2-naphthalen-1-yloxyacetamide
CID 3389667
[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 2-nitrobenzoate
CID 2619259
[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 2-(2,6-dimethylphenoxy)acetate
CID 8527827
N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-fluorophenoxy)acetamide
CID 7834460
2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide
CID 18100358
[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 2-(2-chlorophenyl)acetate
CID 8631752

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide (CID 7199369) is 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide is Cc1ccc(NC(=O)NC(=O)COc2ccccc2C(N)=O)c(C)c1.
What is the InChIKey of 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide?
The InChIKey is XNYCUWCCHLGVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-11-7-8-14(12(2)9-11)20-18(24)21-16(22)10-25-15-6-4-3-5-13(15)17(19)23/h3-9H,10H2,1-2H3,(H2,19,23)(H2,20,21,22,24).
What are the key properties of 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide?
2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide has a molecular weight of 341.37 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 7199369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).