N',N'-diethyl-N-(2-methoxyphenyl)oxamide

C13H18N2O3 — CID 47335830

IUPACN',N'-diethyl-N-(2-methoxyphenyl)oxamide
SMILESCCN(CC)C(=O)C(=O)Nc1ccccc1OC
InChIInChI=1S/C13H18N2O3/c1-4-15(5-2)13(17)12(16)14-10-8-6-7-9-11(10)18-3/h6-9H,4-5H2,1-3H3,(H,14,16)
InChIKeyOBGDIRLCFAHYKP-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.50
Rot. Bonds4

About N',N'-diethyl-N-(2-methoxyphenyl)oxamide

N',N'-diethyl-N-(2-methoxyphenyl)oxamide (PubChem CID 47335830) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N',N'-diethyl-N-(2-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN',N'-diethyl-N-(2-methoxyphenyl)oxamide
PubChem CID47335830
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN',N'-diethyl-N-(2-methoxyphenyl)oxamide
SMILESCCN(CC)C(=O)C(=O)Nc1ccccc1OC
InChIInChI=1S/C13H18N2O3/c1-4-15(5-2)13(17)12(16)14-10-8-6-7-9-11(10)18-3/h6-9H,4-5H2,1-3H3,(H,14,16)
InChIKeyOBGDIRLCFAHYKP-UHFFFAOYSA-N
XLogP1.50
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-ethyl-N-(2-methoxyphenyl)-N'-(2-methylprop-2-enyl)oxamide
CID 91650552
methyl 3-[ethyl-[(2-methoxyphenyl)carbamoyl]amino]propanoate
CID 61011322
2-(N-ethylanilino)-N-(2-methoxyphenyl)acetamide
CID 17052689
N-(2-ethoxyphenyl)-N',N'-dipropyloxamide
CID 108528706
(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
CID 119267268
1-N,1-N-diethyl-2-N-(2-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109139341
N-butyl-N'-(2-methoxyphenyl)oxamide
CID 2247832
1-ethyl-1-[(3-fluorophenyl)methyl]-3-(2-methoxyphenyl)urea
CID 24528941
N-(5-chloro-2-methoxyphenyl)-N'-ethyl-N'-(2-hydroxyethyl)oxamide
CID 47336209
3-(2-methoxyphenyl)-1,1-dimethylurea
CID 4216204
ethane;(2-methoxyphenyl)urea
CID 143063924
N-(2-methoxyethyl)-N'-(2-methoxyphenyl)oxamide
CID 2250932

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(2-methoxyphenyl)oxamide?
The IUPAC name of N',N'-diethyl-N-(2-methoxyphenyl)oxamide (CID 47335830) is N',N'-diethyl-N-(2-methoxyphenyl)oxamide.
What is the SMILES notation for N',N'-diethyl-N-(2-methoxyphenyl)oxamide?
The canonical SMILES for N',N'-diethyl-N-(2-methoxyphenyl)oxamide is CCN(CC)C(=O)C(=O)Nc1ccccc1OC.
What is the InChIKey of N',N'-diethyl-N-(2-methoxyphenyl)oxamide?
The InChIKey is OBGDIRLCFAHYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-4-15(5-2)13(17)12(16)14-10-8-6-7-9-11(10)18-3/h6-9H,4-5H2,1-3H3,(H,14,16).
What are the key properties of N',N'-diethyl-N-(2-methoxyphenyl)oxamide?
N',N'-diethyl-N-(2-methoxyphenyl)oxamide has a molecular weight of 250.30 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(2-methoxyphenyl)oxamide is sourced from PubChem (CID 47335830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).