N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide

C20H24N2O4 — CID 86982939

IUPACN-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide
SMILESCCN(Cc1ccccc1NC(=O)c1ccc(OC)cc1OC)C(C)=O
InChIInChI=1S/C20H24N2O4/c1-5-22(14(2)23)13-15-8-6-7-9-18(15)21-20(24)17-11-10-16(25-3)12-19(17)26-4/h6-12H,5,13H2,1-4H3,(H,21,24)
InChIKeyNCDHWFPBJAFPPH-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.32
Rot. Bonds7

About N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide

N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide (PubChem CID 86982939) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide
PubChem CID86982939
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide
SMILESCCN(Cc1ccccc1NC(=O)c1ccc(OC)cc1OC)C(C)=O
InChIInChI=1S/C20H24N2O4/c1-5-22(14(2)23)13-15-8-6-7-9-18(15)21-20(24)17-11-10-16(25-3)12-19(17)26-4/h6-12H,5,13H2,1-4H3,(H,21,24)
InChIKeyNCDHWFPBJAFPPH-UHFFFAOYSA-N
XLogP3.32
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide?
The IUPAC name of N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide (CID 86982939) is N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide is CCN(Cc1ccccc1NC(=O)c1ccc(OC)cc1OC)C(C)=O.
What is the InChIKey of N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide?
The InChIKey is NCDHWFPBJAFPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-5-22(14(2)23)13-15-8-6-7-9-18(15)21-20(24)17-11-10-16(25-3)12-19(17)26-4/h6-12H,5,13H2,1-4H3,(H,21,24).
What are the key properties of N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide?
N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide has a molecular weight of 356.42 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[acetyl(ethyl)amino]methyl]phenyl]-2,4-dimethoxybenzamide is sourced from PubChem (CID 86982939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).