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

C20H24N2O5 — CID 90598995

IUPACN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2C)cc1OC
InChIInChI=1S/C20H24N2O5/c1-13-7-5-6-8-15(13)18(27-4)12-21-19(23)20(24)22-14-9-10-16(25-2)17(11-14)26-3/h5-11,18H,12H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyIWNDFKLFPNVPFF-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.45
Rot. Bonds7

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

N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide (PubChem CID 90598995) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide.

Molecular Properties

Compound NameN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
PubChem CID90598995
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2C)cc1OC
InChIInChI=1S/C20H24N2O5/c1-13-7-5-6-8-15(13)18(27-4)12-21-19(23)20(24)22-14-9-10-16(25-2)17(11-14)26-3/h5-11,18H,12H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyIWNDFKLFPNVPFF-UHFFFAOYSA-N
XLogP2.45
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-methoxyphenyl)ethyl]oxamide
CID 90598246
N-[2-methoxy-2-(2-methylphenyl)ethyl]-N'-(2,4,6-trimethylphenyl)oxamide
CID 90598970
N'-(3,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 7585276
N'-(3,4-dimethoxyphenyl)-N-(2-hydroxy-2-naphthalen-1-ylethyl)oxamide
CID 90497468
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598239
N'-(2,3-dimethylphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598203
N-[(2S)-2-methoxy-2-(2-methylphenyl)ethyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 97417837
2-methoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598704
N'-(3,4-dimethoxyphenyl)-N-phenyloxamide
CID 44999686
N'-(3-chloro-2-methylphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
CID 90598984
N-[2-methoxy-2-(2-methylphenyl)ethyl]-N'-(1-phenylethyl)oxamide
CID 71810558
N'-cyclopropyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
CID 71810552

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide?
The IUPAC name of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide (CID 90598995) is N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide.
What is the SMILES notation for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide?
The canonical SMILES for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide is COc1ccc(NC(=O)C(=O)NCC(OC)c2ccccc2C)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide?
The InChIKey is IWNDFKLFPNVPFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-13-7-5-6-8-15(13)18(27-4)12-21-19(23)20(24)22-14-9-10-16(25-2)17(11-14)26-3/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-methylphenyl)ethyl]oxamide?
N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide has a molecular weight of 372.42 g/mol, XLogP of 2.45, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide is sourced from PubChem (CID 90598995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).