N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide

C20H24N2O6 — CID 90598246

IUPACN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2OC)cc1OC
InChIInChI=1S/C20H24N2O6/c1-25-15-8-6-5-7-14(15)18(28-4)12-21-19(23)20(24)22-13-9-10-16(26-2)17(11-13)27-3/h5-11,18H,12H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyOAVRYSXYBSESHC-UHFFFAOYSA-N
MW388.42 g/mol
LogP2.15
Rot. Bonds8

About N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide

N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide (PubChem CID 90598246) has the molecular formula C20H24N2O6 and a molecular weight of 388.42 g/mol. Its IUPAC name is N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide.

Molecular Properties

Compound NameN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
PubChem CID90598246
Molecular FormulaC20H24N2O6
Molecular Weight388.42 g/mol
Exact Mass388.16
IUPAC NameN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2OC)cc1OC
InChIInChI=1S/C20H24N2O6/c1-25-15-8-6-5-7-14(15)18(28-4)12-21-19(23)20(24)22-13-9-10-16(26-2)17(11-13)27-3/h5-11,18H,12H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyOAVRYSXYBSESHC-UHFFFAOYSA-N
XLogP2.15
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
CID 90598995
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598239
N'-(3,4-dimethoxyphenyl)-N-(2-hydroxy-2-naphthalen-1-ylethyl)oxamide
CID 90497468
N'-(2,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598245
N'-(2,3-dimethylphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598203
N'-(3,4-dimethoxyphenyl)-N-phenyloxamide
CID 44999686
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-N'-(2-nitrophenyl)oxamide
CID 90598230
1-(4-tert-butylphenyl)-3-[2-methoxy-2-(2-methoxyphenyl)ethyl]urea
CID 90598283
N'-(3,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 7585276
N-(2-aminoethyl)-N'-(3,4-dimethoxyphenyl)oxamide
CID 43315993
N-[2-(2-chlorophenyl)-2-methoxyethyl]-N'-(4-propan-2-ylphenyl)oxamide
CID 90623967
1-(5-chloro-2-methoxyphenyl)-3-[(2S)-2-methoxy-2-(2-methoxyphenyl)ethyl]urea
CID 129373912

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide?
The IUPAC name of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide (CID 90598246) is N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide.
What is the SMILES notation for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide?
The canonical SMILES for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide is COc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2OC)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide?
The InChIKey is OAVRYSXYBSESHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O6/c1-25-15-8-6-5-7-14(15)18(28-4)12-21-19(23)20(24)22-13-9-10-16(26-2)17(11-13)27-3/h5-11,18H,12H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide?
N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide has a molecular weight of 388.42 g/mol, XLogP of 2.15, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide is sourced from PubChem (CID 90598246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).