1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide

C24H24N2O4 — CID 58668872

IUPAC1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide
SMILESCON(C)C(=O)c1c(-c2ccccc2)ccc(-c2ccccc2)c1C(=O)N(C)OC
InChIInChI=1S/C24H24N2O4/c1-25(29-3)23(27)21-19(17-11-7-5-8-12-17)15-16-20(18-13-9-6-10-14-18)22(21)24(28)26(2)30-4/h5-16H,1-4H3
InChIKeyMENMALBIVNENEY-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.29
Rot. Bonds6

About 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide

1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide (PubChem CID 58668872) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide
PubChem CID58668872
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide
SMILESCON(C)C(=O)c1c(-c2ccccc2)ccc(-c2ccccc2)c1C(=O)N(C)OC
InChIInChI=1S/C24H24N2O4/c1-25(29-3)23(27)21-19(17-11-7-5-8-12-17)15-16-20(18-13-9-6-10-14-18)22(21)24(28)26(2)30-4/h5-16H,1-4H3
InChIKeyMENMALBIVNENEY-UHFFFAOYSA-N
XLogP4.29
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide?
The IUPAC name of 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide (CID 58668872) is 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide.
What is the SMILES notation for 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide?
The canonical SMILES for 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide is CON(C)C(=O)c1c(-c2ccccc2)ccc(-c2ccccc2)c1C(=O)N(C)OC.
What is the InChIKey of 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide?
The InChIKey is MENMALBIVNENEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-25(29-3)23(27)21-19(17-11-7-5-8-12-17)15-16-20(18-13-9-6-10-14-18)22(21)24(28)26(2)30-4/h5-16H,1-4H3.
What are the key properties of 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide?
1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide has a molecular weight of 404.47 g/mol, XLogP of 4.29, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N-dimethoxy-1-N,2-N-dimethyl-3,6-diphenylbenzene-1,2-dicarboxamide is sourced from PubChem (CID 58668872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).