ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate

C19H20N4O4 — CID 68583605

IUPACethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate
SMILESCCOC(=O)c1cn(-c2ccccc2)c2nc(NCCOC)ncc2c1=O
InChIInChI=1S/C19H20N4O4/c1-3-27-18(25)15-12-23(13-7-5-4-6-8-13)17-14(16(15)24)11-21-19(22-17)20-9-10-26-2/h4-8,11-12H,3,9-10H2,1-2H3,(H,20,21,22)
InChIKeyUYKPVNLWIDODCC-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.02
Rot. Bonds7

About ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate

ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate (PubChem CID 68583605) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate.

Molecular Properties

Compound Nameethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate
PubChem CID68583605
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Nameethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate
SMILESCCOC(=O)c1cn(-c2ccccc2)c2nc(NCCOC)ncc2c1=O
InChIInChI=1S/C19H20N4O4/c1-3-27-18(25)15-12-23(13-7-5-4-6-8-13)17-14(16(15)24)11-21-19(22-17)20-9-10-26-2/h4-8,11-12H,3,9-10H2,1-2H3,(H,20,21,22)
InChIKeyUYKPVNLWIDODCC-UHFFFAOYSA-N
XLogP2.02
TPSA95.34 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate 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

5-oxo-8-phenyl-2-(2-pyrrolidin-1-ylethylamino)pyrido[2,3-d]pyrimidine-6-carboxamide
CID 68584083
2-(benzylamino)-N-cyclopropyl-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 155672586
2-(benzylamino)-5-oxo-8-phenyl-N-prop-2-ynylpyrido[2,3-d]pyrimidine-6-carboxamide
CID 155672568
ethyl 4-oxo-1-pyridin-3-yl-1,8-naphthyridine-3-carboxylate
CID 12972530
ethyl 2-[[5-(2-methoxyethylamino)pyridine-2-carbonyl]amino]benzoate
CID 109184186
ethyl 8-cyclohexyl-5-oxo-2-(3-pyrrolidin-1-ylpropylamino)pyrido[2,3-d]pyrimidine-6-carboxylate
CID 68583351
ethyl 2-[[6-(2-methoxyethylamino)-2-methylpyrimidine-4-carbonyl]amino]benzoate
CID 109364795
ethyl 8-(2,3-dihydro-1H-inden-5-yl)-2-[3-(3,5-dimethylpiperazin-1-yl)anilino]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate
CID 68678399
ethyl 8-cyclohexyl-2-[3-(4-methylpiperazin-1-yl)propylamino]-5-oxopyrido[2,3-d]pyrimidine-6-carboxylate
CID 68584492
ethyl 2-[2-[2-methoxyethyl(methyl)amino]ethylamino]-4-methylpyrimidine-5-carboxylate
CID 83178869
8-(4-ethylphenyl)-N-methoxy-2-methylsulfanyl-5-oxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 86620192
ethyl 1-[2-(2-ethoxycarbonylanilino)-2-oxoethyl]-7-methyl-4-oxo-1,8-naphthyridine-3-carboxylate
CID 20940917

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate?
The IUPAC name of ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate (CID 68583605) is ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate.
What is the SMILES notation for ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate?
The canonical SMILES for ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate is CCOC(=O)c1cn(-c2ccccc2)c2nc(NCCOC)ncc2c1=O.
What is the InChIKey of ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate?
The InChIKey is UYKPVNLWIDODCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-3-27-18(25)15-12-23(13-7-5-4-6-8-13)17-14(16(15)24)11-21-19(22-17)20-9-10-26-2/h4-8,11-12H,3,9-10H2,1-2H3,(H,20,21,22).
What are the key properties of ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate?
ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate has a molecular weight of 368.39 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-methoxyethylamino)-5-oxo-8-phenylpyrido[2,3-d]pyrimidine-6-carboxylate is sourced from PubChem (CID 68583605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).