5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

C18H24N4O5 — CID 16845308

IUPAC5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCc1cnc2c(c1NCC1(OC)C=CC(OC)O1)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C18H24N4O5/c1-6-11-9-19-15-13(16(23)22(3)17(24)21(15)2)14(11)20-10-18(26-5)8-7-12(25-4)27-18/h7-9,12H,6,10H2,1-5H3,(H,19,20)
InChIKeyGYQBOXBOBUIXEH-UHFFFAOYSA-N
MW376.41 g/mol
LogP0.51
Rot. Bonds6

About 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 16845308) has the molecular formula C18H24N4O5 and a molecular weight of 376.41 g/mol. Its IUPAC name is 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID16845308
Molecular FormulaC18H24N4O5
Molecular Weight376.41 g/mol
Exact Mass376.17
IUPAC Name5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCc1cnc2c(c1NCC1(OC)C=CC(OC)O1)c(=O)n(C)c(=O)n2C
InChIInChI=1S/C18H24N4O5/c1-6-11-9-19-15-13(16(23)22(3)17(24)21(15)2)14(11)20-10-18(26-5)8-7-12(25-4)27-18/h7-9,12H,6,10H2,1-5H3,(H,19,20)
InChIKeyGYQBOXBOBUIXEH-UHFFFAOYSA-N
XLogP0.51
TPSA96.61 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_misc_A(5)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione 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-(2,2-dimethoxyethylamino)-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845281
N-(6-ethyl-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)furan-2-carboxamide
CID 16840961
N-(6-ethyl-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)-2-(4-methoxyphenyl)acetamide
CID 16840940
N-(6-ethyl-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)-3,4,5-trimethoxybenzamide
CID 16840883
5-(cycloheptylamino)-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845292
6-ethyl-1,3-dimethyl-5-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidine-2,4-dione
CID 16845380
5-(3-acetylanilino)-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845344
5-(2-methoxyethylamino)-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16802512
5-(2,5-dichloroanilino)-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845354
5-(2,5-difluoroanilino)-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845356
2-cyclohexyl-N-(6-ethyl-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)acetamide
CID 16840851
5-[bis(2-methoxyethyl)amino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845239

Frequently Asked Questions

What is the IUPAC name of 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione (CID 16845308) is 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione is CCc1cnc2c(c1NCC1(OC)C=CC(OC)O1)c(=O)n(C)c(=O)n2C.
What is the InChIKey of 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is GYQBOXBOBUIXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O5/c1-6-11-9-19-15-13(16(23)22(3)17(24)21(15)2)14(11)20-10-18(26-5)8-7-12(25-4)27-18/h7-9,12H,6,10H2,1-5H3,(H,19,20).
What are the key properties of 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione?
5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 376.41 g/mol, XLogP of 0.51, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,5-dimethoxy-2H-furan-5-yl)methylamino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 16845308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).