ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate

C19H25N3O3 — CID 133277740

IUPACethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate
SMILESCCOC(=O)c1cnc2ccccc2c1NCC(C)N1CCOCC1
InChIInChI=1S/C19H25N3O3/c1-3-25-19(23)16-13-20-17-7-5-4-6-15(17)18(16)21-12-14(2)22-8-10-24-11-9-22/h4-7,13-14H,3,8-12H2,1-2H3,(H,20,21)
InChIKeyFDRWYBITMXOBSU-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.54
Rot. Bonds6

About ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate

ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate (PubChem CID 133277740) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate.

Molecular Properties

Compound Nameethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate
PubChem CID133277740
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Nameethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate
SMILESCCOC(=O)c1cnc2ccccc2c1NCC(C)N1CCOCC1
InChIInChI=1S/C19H25N3O3/c1-3-25-19(23)16-13-20-17-7-5-4-6-15(17)18(16)21-12-14(2)22-8-10-24-11-9-22/h4-7,13-14H,3,8-12H2,1-2H3,(H,20,21)
InChIKeyFDRWYBITMXOBSU-UHFFFAOYSA-N
XLogP2.54
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-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

Related Compounds

ethyl 4-(prop-2-enylamino)quinoline-3-carboxylate
CID 13295816
ethyl 4-[[(2R)-oxolan-2-yl]methylamino]quinoline-3-carboxylate
CID 94374245
ethyl 4-(2-phenylethylamino)quinoline-3-carboxylate
CID 709117
2-[[(2S)-2-morpholin-4-ylpropyl]amino]quinoline-4-carboxamide
CID 94022811
ethyl 6-ethyl-4-(2-morpholin-4-ylethylamino)quinoline-3-carboxylate
CID 1188194
ethyl 4-[[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]amino]quinoline-3-carboxylate
CID 49429094
ethyl 4-[4-(2-methylpropoxy)anilino]quinoline-3-carboxylate
CID 23731775
ethyl 4-(4-acetamidoanilino)quinoline-3-carboxylate
CID 66715927
ethane;ethyl 4-aminoquinoline-3-carboxylate
CID 143157176
ethyl 4-[[(2R)-2-hydroxypropyl]amino]-6-phenoxyquinoline-3-carboxylate
CID 1188199
ethyl 4-[(3-ethylsulfinylcyclohexyl)amino]quinoline-3-carboxylate
CID 133338071
3-O-ethyl 8-O-methyl 4-(2-morpholin-4-ylethylamino)quinoline-3,8-dicarboxylate
CID 1191454

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate?
The IUPAC name of ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate (CID 133277740) is ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate.
What is the SMILES notation for ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate?
The canonical SMILES for ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate is CCOC(=O)c1cnc2ccccc2c1NCC(C)N1CCOCC1.
What is the InChIKey of ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate?
The InChIKey is FDRWYBITMXOBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-3-25-19(23)16-13-20-17-7-5-4-6-15(17)18(16)21-12-14(2)22-8-10-24-11-9-22/h4-7,13-14H,3,8-12H2,1-2H3,(H,20,21).
What are the key properties of ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate?
ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate has a molecular weight of 343.43 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(2-morpholin-4-ylpropylamino)quinoline-3-carboxylate is sourced from PubChem (CID 133277740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).