ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate

C19H21N3O4 — CID 109228723

IUPACethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C19H21N3O4/c1-2-26-19(24)16-5-3-4-6-17(16)21-18(23)14-11-15(13-20-12-14)22-7-9-25-10-8-22/h3-6,11-13H,2,7-10H2,1H3,(H,21,23)
InChIKeyHLIUVHHICZQNPX-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.35
Rot. Bonds5

About ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate

ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate (PubChem CID 109228723) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate.

Molecular Properties

Compound Nameethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate
PubChem CID109228723
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Nameethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C19H21N3O4/c1-2-26-19(24)16-5-3-4-6-17(16)21-18(23)14-11-15(13-20-12-14)22-7-9-25-10-8-22/h3-6,11-13H,2,7-10H2,1H3,(H,21,23)
InChIKeyHLIUVHHICZQNPX-UHFFFAOYSA-N
XLogP2.35
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate 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-methylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228626
N-[(2-methylphenyl)methyl]-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228561
ethyl 2-[[4-(morpholine-4-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109082942
ethyl 2-[[5-(3-methylpiperidine-1-carbonyl)pyridine-3-carbonyl]amino]benzoate
CID 109107562
ethyl 2-[[5-(pentylcarbamoyl)pyridine-3-carbonyl]amino]benzoate
CID 109107303
N-(3,4-dimethylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228634
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109238094
ethyl 2-[(2-piperidin-1-ylpyrimidine-5-carbonyl)amino]benzoate
CID 109250266
ethyl 2-[[3-[(2-ethoxycarbonylphenyl)carbamoyl]benzoyl]amino]benzoate
CID 4013454
2-[(5-ethoxycarbonyl-2-morpholin-4-ylphenyl)carbamoyl]benzoic acid
CID 2811007
methyl 2-[(2-morpholin-4-ylpyrimidine-5-carbonyl)amino]benzoate
CID 109252285
N-(3-acetylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228678

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate?
The IUPAC name of ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate (CID 109228723) is ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate.
What is the SMILES notation for ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate?
The canonical SMILES for ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate is CCOC(=O)c1ccccc1NC(=O)c1cncc(N2CCOCC2)c1.
What is the InChIKey of ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate?
The InChIKey is HLIUVHHICZQNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-2-26-19(24)16-5-3-4-6-17(16)21-18(23)14-11-15(13-20-12-14)22-7-9-25-10-8-22/h3-6,11-13H,2,7-10H2,1H3,(H,21,23).
What are the key properties of ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate?
ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate has a molecular weight of 355.39 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(5-morpholin-4-ylpyridine-3-carbonyl)amino]benzoate is sourced from PubChem (CID 109228723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).