N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide

C17H20N2O3 — CID 8689456

IUPACN-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(C)c2ccccc2)c1
InChIInChI=1S/C17H20N2O3/c1-19(13-7-5-4-6-8-13)12-17(20)18-15-11-14(21-2)9-10-16(15)22-3/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyXEGASOAIQZRNGB-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.78
Rot. Bonds6

About N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide

N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide (PubChem CID 8689456) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide
PubChem CID8689456
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(C)c2ccccc2)c1
InChIInChI=1S/C17H20N2O3/c1-19(13-7-5-4-6-8-13)12-17(20)18-15-11-14(21-2)9-10-16(15)22-3/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyXEGASOAIQZRNGB-UHFFFAOYSA-N
XLogP2.78
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide (CID 8689456) is N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide is COc1ccc(OC)c(NC(=O)CN(C)c2ccccc2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide?
The InChIKey is XEGASOAIQZRNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-19(13-7-5-4-6-8-13)12-17(20)18-15-11-14(21-2)9-10-16(15)22-3/h4-11H,12H2,1-3H3,(H,18,20).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide?
N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(N-methylanilino)acetamide is sourced from PubChem (CID 8689456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).