N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide

C17H19NO4 — CID 854771

IUPACN-(2,5-dimethoxyphenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C17H19NO4/c1-4-22-13-7-5-12(6-8-13)17(19)18-15-11-14(20-2)9-10-16(15)21-3/h5-11H,4H2,1-3H3,(H,18,19)
InChIKeyUNGWWNOXECZEMK-UHFFFAOYSA-N
MW301.34 g/mol
LogP3.35
Rot. Bonds6

About N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide

N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide (PubChem CID 854771) has the molecular formula C17H19NO4 and a molecular weight of 301.34 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-4-ethoxybenzamide
PubChem CID854771
Molecular FormulaC17H19NO4
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC NameN-(2,5-dimethoxyphenyl)-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C17H19NO4/c1-4-22-13-7-5-12(6-8-13)17(19)18-15-11-14(20-2)9-10-16(15)21-3/h5-11H,4H2,1-3H3,(H,18,19)
InChIKeyUNGWWNOXECZEMK-UHFFFAOYSA-N
XLogP3.35
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Flutolanil
CID 47898
Mepronil
CID 41632
Benzenepropanamide, N-(2-methoxyphenyl)-beta-oxo-
CID 7079
3-Amino-4-methoxybenzanilide
CID 8426
Benzamide, N-(4-amino-2,5-diethoxyphenyl)-
CID 67108
4-Methoxy-N-(4-methoxyphenyl)benzamide
CID 346815
VU0357121
CID 2296132
4-chloro-N-(2,5-dimethoxyphenyl)benzamide
CID 307426
4-Methoxy-N-(3-methylphenyl)benzamide
CID 346046
4-methoxy-N-(3-methoxyphenyl)benzamide
CID 687087
N,N'-Bis(3-methoxyphenyl)terephthalamide
CID 248372
N-(4-Ethoxyphenyl)-4-methoxybenzamide
CID 584690

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide (CID 854771) is N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide is CCOc1ccc(C(=O)Nc2cc(OC)ccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide?
The InChIKey is UNGWWNOXECZEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4/c1-4-22-13-7-5-12(6-8-13)17(19)18-15-11-14(20-2)9-10-16(15)21-3/h5-11H,4H2,1-3H3,(H,18,19).
What are the key properties of N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide?
N-(2,5-dimethoxyphenyl)-4-ethoxybenzamide has a molecular weight of 301.34 g/mol, XLogP of 3.35, 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)-4-ethoxybenzamide is sourced from PubChem (CID 854771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).