ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate

C17H18N4O3 — CID 18953495

IUPACethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate
SMILESCCOC(=O)c1ncn2c1nc(N1CCOCC1)c1ccccc12
InChIInChI=1S/C17H18N4O3/c1-2-24-17(22)14-16-19-15(20-7-9-23-10-8-20)12-5-3-4-6-13(12)21(16)11-18-14/h3-6,11H,2,7-10H2,1H3
InChIKeyKZCPZBKFNGYQQI-UHFFFAOYSA-N
MW326.36 g/mol
LogP1.90
Rot. Bonds3

About ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate

ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate (PubChem CID 18953495) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate.

Molecular Properties

Compound Nameethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate
PubChem CID18953495
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Nameethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate
SMILESCCOC(=O)c1ncn2c1nc(N1CCOCC1)c1ccccc12
InChIInChI=1S/C17H18N4O3/c1-2-24-17(22)14-16-19-15(20-7-9-23-10-8-20)12-5-3-4-6-13(12)21(16)11-18-14/h3-6,11H,2,7-10H2,1H3
InChIKeyKZCPZBKFNGYQQI-UHFFFAOYSA-N
XLogP1.90
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate?
The IUPAC name of ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate (CID 18953495) is ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate.
What is the SMILES notation for ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate?
The canonical SMILES for ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate is CCOC(=O)c1ncn2c1nc(N1CCOCC1)c1ccccc12.
What is the InChIKey of ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate?
The InChIKey is KZCPZBKFNGYQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-2-24-17(22)14-16-19-15(20-7-9-23-10-8-20)12-5-3-4-6-13(12)21(16)11-18-14/h3-6,11H,2,7-10H2,1H3.
What are the key properties of ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate?
ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate has a molecular weight of 326.36 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate is sourced from PubChem (CID 18953495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).