2-ethoxy-3,4-dimethoxybenzamide

C11H15NO4 — CID 141309813

IUPAC2-ethoxy-3,4-dimethoxybenzamide
SMILESCCOc1c(C(N)=O)ccc(OC)c1OC
InChIInChI=1S/C11H15NO4/c1-4-16-9-7(11(12)13)5-6-8(14-2)10(9)15-3/h5-6H,4H2,1-3H3,(H2,12,13)
InChIKeyKTOVSMQLFWRXPL-UHFFFAOYSA-N
MW225.24 g/mol
LogP1.20
Rot. Bonds5

About 2-ethoxy-3,4-dimethoxybenzamide

2-ethoxy-3,4-dimethoxybenzamide (PubChem CID 141309813) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 2-ethoxy-3,4-dimethoxybenzamide.

Molecular Properties

Compound Name2-ethoxy-3,4-dimethoxybenzamide
PubChem CID141309813
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name2-ethoxy-3,4-dimethoxybenzamide
SMILESCCOc1c(C(N)=O)ccc(OC)c1OC
InChIInChI=1S/C11H15NO4/c1-4-16-9-7(11(12)13)5-6-8(14-2)10(9)15-3/h5-6H,4H2,1-3H3,(H2,12,13)
InChIKeyKTOVSMQLFWRXPL-UHFFFAOYSA-N
XLogP1.20
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethoxy-2,4-dimethoxybenzoic acid
CID 171009382
6-carbamoyl-2,3-dimethoxybenzoic acid
CID 90976735
4-ethoxynaphthalene-1-carboxamide;fluoromethane
CID 143061073
2,3-dimethoxybenzamide;hydrate
CID 141005510
ethyl 3,4-dimethoxy-2-methylbenzoate
CID 23043983
ethyl 3-oxo-3-(2,3,4-trimethoxyphenyl)propanoate
CID 21243225
8-ethoxy-7-methoxy-9H-carbazole-4-carboxamide
CID 140536820
4,8-dimethoxynaphthalene-1,5-dicarboxamide
CID 100971321
ethane;ethyl 2-(2,3,4-trimethoxyphenoxy)acetate
CID 144536056
3-ethoxy-1-iodo-2,4-dimethoxybenzene
CID 118835970
ethyl 2-ethoxy-3-methoxybenzoate
CID 82186199
(3S)-3-amino-3-(2,3,4-trimethoxyphenyl)propanamide
CID 29059945

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3,4-dimethoxybenzamide?
The IUPAC name of 2-ethoxy-3,4-dimethoxybenzamide (CID 141309813) is 2-ethoxy-3,4-dimethoxybenzamide.
What is the SMILES notation for 2-ethoxy-3,4-dimethoxybenzamide?
The canonical SMILES for 2-ethoxy-3,4-dimethoxybenzamide is CCOc1c(C(N)=O)ccc(OC)c1OC.
What is the InChIKey of 2-ethoxy-3,4-dimethoxybenzamide?
The InChIKey is KTOVSMQLFWRXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-4-16-9-7(11(12)13)5-6-8(14-2)10(9)15-3/h5-6H,4H2,1-3H3,(H2,12,13).
What are the key properties of 2-ethoxy-3,4-dimethoxybenzamide?
2-ethoxy-3,4-dimethoxybenzamide has a molecular weight of 225.24 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3,4-dimethoxybenzamide is sourced from PubChem (CID 141309813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).