N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide

C20H24N2O6 — CID 108987392

IUPACN-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)cc(OC)c1OC
InChIInChI=1S/C20H24N2O6/c1-12(2)28-15-8-6-13(7-9-15)21-19(23)20(24)22-14-10-16(25-3)18(27-5)17(11-14)26-4/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyUIWCKSZQODXAGU-UHFFFAOYSA-N
MW388.42 g/mol
LogP3.08
Rot. Bonds7

About N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide

N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide (PubChem CID 108987392) has the molecular formula C20H24N2O6 and a molecular weight of 388.42 g/mol. Its IUPAC name is N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide.

Molecular Properties

Compound NameN-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
PubChem CID108987392
Molecular FormulaC20H24N2O6
Molecular Weight388.42 g/mol
Exact Mass388.16
IUPAC NameN-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)cc(OC)c1OC
InChIInChI=1S/C20H24N2O6/c1-12(2)28-15-8-6-13(7-9-15)21-19(23)20(24)22-14-10-16(25-3)18(27-5)17(11-14)26-4/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyUIWCKSZQODXAGU-UHFFFAOYSA-N
XLogP3.08
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 53.08
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-(4-acetylphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108987472
1-(4-propan-2-yloxyphenyl)-3-[2-(3,4,5-trimethoxyphenyl)ethyl]urea
CID 113217169
N-(2,4-dimethoxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108987426
2-oxo-2-(4-propan-2-yloxyanilino)acetic acid
CID 28710622
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 110761096
2-(4-bromophenoxy)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 18083742
2-phenoxy-N-(3,4,5-trimethoxyphenyl)propanamide
CID 2991764
3,4,5-trimethoxy-N-(3-methoxy-4-propan-2-yloxyphenyl)benzamide
CID 26435232
4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373
1-(3-chloro-4-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)urea
CID 108991931
3,4,5-trimethoxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154687
N-(3-acetamidophenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108987482

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide?
The IUPAC name of N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide (CID 108987392) is N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide.
What is the SMILES notation for N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide?
The canonical SMILES for N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide is COc1cc(NC(=O)C(=O)Nc2ccc(OC(C)C)cc2)cc(OC)c1OC.
What is the InChIKey of N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide?
The InChIKey is UIWCKSZQODXAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O6/c1-12(2)28-15-8-6-13(7-9-15)21-19(23)20(24)22-14-10-16(25-3)18(27-5)17(11-14)26-4/h6-12H,1-5H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide?
N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide has a molecular weight of 388.42 g/mol, XLogP of 3.08, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yloxyphenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide is sourced from PubChem (CID 108987392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).