3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide

C15H22N2O4 — CID 9481076

IUPAC3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
SMILESCOc1cccc(CCC(=O)NCC(=O)N(C)C)c1OC
InChIInChI=1S/C15H22N2O4/c1-17(2)14(19)10-16-13(18)9-8-11-6-5-7-12(20-3)15(11)21-4/h5-7H,8-10H2,1-4H3,(H,16,18)
InChIKeyQNCLCVHEPXPBIZ-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.84
Rot. Bonds7

About 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide

3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide (PubChem CID 9481076) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide.

Molecular Properties

Compound Name3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
PubChem CID9481076
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
SMILESCOc1cccc(CCC(=O)NCC(=O)N(C)C)c1OC
InChIInChI=1S/C15H22N2O4/c1-17(2)14(19)10-16-13(18)9-8-11-6-5-7-12(20-3)15(11)21-4/h5-7H,8-10H2,1-4H3,(H,16,18)
InChIKeyQNCLCVHEPXPBIZ-UHFFFAOYSA-N
XLogP0.84
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(tert-butylamino)-2-oxoethyl]-3-(2,3-dimethoxyphenyl)propanamide
CID 18118508
3-(2,3-dimethoxyphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 9483500
3-(2-bromophenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide
CID 51085814
2-[3-(2,3,4-trimethoxyphenyl)propanoylamino]acetic acid
CID 119171700
2-[3-(2-methoxyphenyl)propanoylamino]acetic acid
CID 43091942
3-(2,3-dimethoxyphenyl)-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 22108283
3-(2,3-dimethoxyphenyl)-N-[2-(3-fluorophenyl)ethyl]propanamide
CID 18118791
3-(2,3-dimethoxyphenyl)-N'-[2-(4-fluorophenyl)acetyl]propanehydrazide
CID 9428782
N-[(2,3-dimethoxyphenyl)methyl]-2-methoxyacetamide
CID 47161214
1-amino-4-(2,3-dimethoxyphenyl)butan-2-one;hydrochloride
CID 67393300
3-(2,3-dimethoxyphenyl)-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]propanamide
CID 9020974
1-[2-(2,3-dimethoxyphenyl)ethyl]-1-methylurea
CID 3052715

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide?
The IUPAC name of 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide (CID 9481076) is 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide.
What is the SMILES notation for 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide?
The canonical SMILES for 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide is COc1cccc(CCC(=O)NCC(=O)N(C)C)c1OC.
What is the InChIKey of 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide?
The InChIKey is QNCLCVHEPXPBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-17(2)14(19)10-16-13(18)9-8-11-6-5-7-12(20-3)15(11)21-4/h5-7H,8-10H2,1-4H3,(H,16,18).
What are the key properties of 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide?
3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide has a molecular weight of 294.35 g/mol, XLogP of 0.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethoxyphenyl)-N-[2-(dimethylamino)-2-oxoethyl]propanamide is sourced from PubChem (CID 9481076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).