5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one

C18H18N2O3S — CID 5309656

IUPAC5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one
SMILESCCn1c(=O)c2cc(C(=O)N3CCOCC3)sc2c2ccccc21
InChIInChI=1S/C18H18N2O3S/c1-2-20-14-6-4-3-5-12(14)16-13(17(20)21)11-15(24-16)18(22)19-7-9-23-10-8-19/h3-6,11H,2,7-10H2,1H3
InChIKeyDDIJCORLICNGIC-UHFFFAOYSA-N
MW342.42 g/mol
LogP2.71
Rot. Bonds2

About 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one

5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one (PubChem CID 5309656) has the molecular formula C18H18N2O3S and a molecular weight of 342.42 g/mol. Its IUPAC name is 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one.

Molecular Properties

Compound Name5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one
PubChem CID5309656
Molecular FormulaC18H18N2O3S
Molecular Weight342.42 g/mol
Exact Mass342.10
IUPAC Name5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one
SMILESCCn1c(=O)c2cc(C(=O)N3CCOCC3)sc2c2ccccc21
InChIInChI=1S/C18H18N2O3S/c1-2-20-14-6-4-3-5-12(14)16-13(17(20)21)11-15(24-16)18(22)19-7-9-23-10-8-19/h3-6,11H,2,7-10H2,1H3
InChIKeyDDIJCORLICNGIC-UHFFFAOYSA-N
XLogP2.71
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(4-chlorophenyl)piperazine-1-carbonyl]-5-ethylthieno[3,2-c]quinolin-4-one
CID 20865373
5-ethyl-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]thieno[3,2-c]quinolin-4-one
CID 20865318
2-(4-benzylpiperidine-1-carbonyl)-5-ethylthieno[3,2-c]quinolin-4-one
CID 20865301
N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 6622578
5-ethyl-4-oxo-N-(3-pyrrolidin-1-ylpropyl)thieno[3,2-c]quinoline-2-carboxamide
CID 20865333
N-(2-cyanoethyl)-5-ethyl-N-methyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 6622369
N-(3,4-dimethylphenyl)-5-ethyl-N-methyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 20865347
N-cyclohexyl-5-ethyl-4-oxo-N-propan-2-ylthieno[3,2-c]quinoline-2-carboxamide
CID 20865413
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 20865329
5-ethyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 20865415
5-methyl-2-(4-piperidin-1-ylpiperidine-1-carbonyl)thieno[3,2-c]quinolin-4-one
CID 20857497
5-ethyl-N-(furan-2-ylmethyl)-N-(3-methylbutyl)-4-oxothieno[3,2-c]quinoline-2-carboxamide
CID 20865433

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one?
The IUPAC name of 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one (CID 5309656) is 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one.
What is the SMILES notation for 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one?
The canonical SMILES for 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one is CCn1c(=O)c2cc(C(=O)N3CCOCC3)sc2c2ccccc21.
What is the InChIKey of 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one?
The InChIKey is DDIJCORLICNGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3S/c1-2-20-14-6-4-3-5-12(14)16-13(17(20)21)11-15(24-16)18(22)19-7-9-23-10-8-19/h3-6,11H,2,7-10H2,1H3.
What are the key properties of 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one?
5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one has a molecular weight of 342.42 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(morpholine-4-carbonyl)thieno[3,2-c]quinolin-4-one is sourced from PubChem (CID 5309656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).