3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide

C13H19N3O4 — CID 115597601

IUPAC3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
SMILESCOCCNC(=O)CNC(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C13H19N3O4/c1-19-6-5-15-12(17)8-16-13(18)9-3-4-11(20-2)10(14)7-9/h3-4,7H,5-6,8,14H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyUHDXNZVBBVRTLU-UHFFFAOYSA-N
MW281.31 g/mol
LogP-0.23
Rot. Bonds7

About 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide

3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide (PubChem CID 115597601) has the molecular formula C13H19N3O4 and a molecular weight of 281.31 g/mol. Its IUPAC name is 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
PubChem CID115597601
Molecular FormulaC13H19N3O4
Molecular Weight281.31 g/mol
Exact Mass281.14
IUPAC Name3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
SMILESCOCCNC(=O)CNC(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C13H19N3O4/c1-19-6-5-15-12(17)8-16-13(18)9-3-4-11(20-2)10(14)7-9/h3-4,7H,5-6,8,14H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyUHDXNZVBBVRTLU-UHFFFAOYSA-N
XLogP-0.23
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide 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

3-amino-4-methoxy-N-(2-methoxyethyl)benzamide
CID 16772972
[2-(2-methoxyethylamino)-2-oxoethyl] 3-amino-4-methoxybenzoate
CID 61485706
3-amino-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 43567615
3-amino-N-[2-(dimethylamino)-2-oxoethyl]-4-methoxybenzamide
CID 43310728
3-amino-N-(2-methoxyethyl)-4-[2-oxo-2-(propylamino)ethoxy]benzamide
CID 93216837
3-amino-N-[2-(diethylamino)-2-oxoethyl]-4-methoxybenzamide
CID 115597740
3-amino-N-(4-amino-4-oxobutyl)-4-methoxybenzamide
CID 60864435
3-amino-4-methoxy-N-(3-propan-2-yloxypropyl)benzamide
CID 82070538
4-fluoro-N-[2-(2-methoxyethylamino)-2-oxoethyl]-3-methylbenzamide
CID 112689546
3-amino-N-(cyclopropylmethyl)-4-methoxybenzamide
CID 16788362
3-fluoro-4-methoxy-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 9163422
N-[2-[2-(dimethylamino)ethylamino]-2-oxoethyl]-3,4-dimethoxybenzamide
CID 112991429

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide?
The IUPAC name of 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide (CID 115597601) is 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide is COCCNC(=O)CNC(=O)c1ccc(OC)c(N)c1.
What is the InChIKey of 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide?
The InChIKey is UHDXNZVBBVRTLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O4/c1-19-6-5-15-12(17)8-16-13(18)9-3-4-11(20-2)10(14)7-9/h3-4,7H,5-6,8,14H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide?
3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide has a molecular weight of 281.31 g/mol, XLogP of -0.23, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-methoxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 115597601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).