1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide

C19H20N2O4 — CID 109043393

IUPAC1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)c2ccc(C(=O)NC3CC3)cc2)c(OC)c1
InChIInChI=1S/C19H20N2O4/c1-24-15-9-10-16(17(11-15)25-2)21-19(23)13-5-3-12(4-6-13)18(22)20-14-7-8-14/h3-6,9-11,14H,7-8H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYTRDOIBZUDVMGL-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.85
Rot. Bonds6

About 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide

1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide (PubChem CID 109043393) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
PubChem CID109043393
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)c2ccc(C(=O)NC3CC3)cc2)c(OC)c1
InChIInChI=1S/C19H20N2O4/c1-24-15-9-10-16(17(11-15)25-2)21-19(23)13-5-3-12(4-6-13)18(22)20-14-7-8-14/h3-6,9-11,14H,7-8H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYTRDOIBZUDVMGL-UHFFFAOYSA-N
XLogP2.85
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109101658
3-N-cyclohexyl-1-N-(2,4-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109052232
N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
4-amino-N-(2,4-dimethoxyphenyl)benzamide
CID 8566750
3-amino-N-cyclopropyl-4-(2,4-dimethoxyanilino)benzamide
CID 100630364
1-N-(2,4-dimethoxyphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043198
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292
4-N-(2,4-dimethoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045814
N-(4-chlorocyclohexyl)-4-methoxybenzamide
CID 114297313
3-N-cycloheptyl-1-N-(2,5-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109056122
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide (CID 109043393) is 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide is COc1ccc(NC(=O)c2ccc(C(=O)NC3CC3)cc2)c(OC)c1.
What is the InChIKey of 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide?
The InChIKey is YTRDOIBZUDVMGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-24-15-9-10-16(17(11-15)25-2)21-19(23)13-5-3-12(4-6-13)18(22)20-14-7-8-14/h3-6,9-11,14H,7-8H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide?
1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide has a molecular weight of 340.38 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 109043393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).