N-(4-acetamido-2,5-dimethoxyphenyl)benzamide

C17H18N2O4 — CID 807852

IUPACN-(4-acetamido-2,5-dimethoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(C)=O
InChIInChI=1S/C17H18N2O4/c1-11(20)18-13-9-16(23-3)14(10-15(13)22-2)19-17(21)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyUZJODYBKFGBZQE-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.91
Rot. Bonds5

About N-(4-acetamido-2,5-dimethoxyphenyl)benzamide

N-(4-acetamido-2,5-dimethoxyphenyl)benzamide (PubChem CID 807852) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-(4-acetamido-2,5-dimethoxyphenyl)benzamide.

Molecular Properties

Compound NameN-(4-acetamido-2,5-dimethoxyphenyl)benzamide
PubChem CID807852
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN-(4-acetamido-2,5-dimethoxyphenyl)benzamide
SMILESCOc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(C)=O
InChIInChI=1S/C17H18N2O4/c1-11(20)18-13-9-16(23-3)14(10-15(13)22-2)19-17(21)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyUZJODYBKFGBZQE-UHFFFAOYSA-N
XLogP2.91
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-2,5-dimethoxyphenyl)benzamide?
The IUPAC name of N-(4-acetamido-2,5-dimethoxyphenyl)benzamide (CID 807852) is N-(4-acetamido-2,5-dimethoxyphenyl)benzamide.
What is the SMILES notation for N-(4-acetamido-2,5-dimethoxyphenyl)benzamide?
The canonical SMILES for N-(4-acetamido-2,5-dimethoxyphenyl)benzamide is COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(C)=O.
What is the InChIKey of N-(4-acetamido-2,5-dimethoxyphenyl)benzamide?
The InChIKey is UZJODYBKFGBZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-11(20)18-13-9-16(23-3)14(10-15(13)22-2)19-17(21)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of N-(4-acetamido-2,5-dimethoxyphenyl)benzamide?
N-(4-acetamido-2,5-dimethoxyphenyl)benzamide has a molecular weight of 314.34 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-2,5-dimethoxyphenyl)benzamide is sourced from PubChem (CID 807852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).