2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide

C18H17N3O2S — CID 97224305

IUPAC2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide
SMILESNC(=O)c1cc(N2CCO[C@H](c3ccsc3)C2)nc2ccccc12
InChIInChI=1S/C18H17N3O2S/c19-18(22)14-9-17(20-15-4-2-1-3-13(14)15)21-6-7-23-16(10-21)12-5-8-24-11-12/h1-5,8-9,11,16H,6-7,10H2,(H2,19,22)/t16-/m0/s1
InChIKeyZXFCWZSBYKPKKA-INIZCTEOSA-N
MW339.42 g/mol
LogP2.97
Rot. Bonds3

About 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide

2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide (PubChem CID 97224305) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide
PubChem CID97224305
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC Name2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide
SMILESNC(=O)c1cc(N2CCO[C@H](c3ccsc3)C2)nc2ccccc12
InChIInChI=1S/C18H17N3O2S/c19-18(22)14-9-17(20-15-4-2-1-3-13(14)15)21-6-7-23-16(10-21)12-5-8-24-11-12/h1-5,8-9,11,16H,6-7,10H2,(H2,19,22)/t16-/m0/s1
InChIKeyZXFCWZSBYKPKKA-INIZCTEOSA-N
XLogP2.97
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide 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

2-[2-(4-chlorophenyl)morpholin-4-yl]quinoline-4-carboxylic acid
CID 56875818
6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid
CID 122054334
2-[(3S)-3-hydroxypiperidin-1-yl]quinoline-4-carboxamide
CID 94022780
2-piperidin-1-ylquinoline-4-carboxamide
CID 22481833
2-(3,5-dimethylpiperazin-1-yl)quinoline-4-carboxamide
CID 63884867
2-(4-morpholin-4-ylpiperidin-1-yl)quinoline-4-carboxamide
CID 117094553
2-[(3R,4R)-3-fluoro-4-hydroxypyrrolidin-1-yl]quinoline-4-carboxamide
CID 154817068
4-(6-ethyl-2-methylpyrimidin-4-yl)-2-thiophen-3-ylmorpholine
CID 133472437
N-cyclopropyl-2-[2-(2-methylphenyl)morpholin-4-yl]quinoline-4-carboxamide
CID 133354287
1-(4-carbamoylquinolin-2-yl)pyrrolidine-2-carboxylic acid
CID 63885030
2-(4-benzoylpiperazin-1-yl)quinoline-4-carboxamide
CID 146039796
acetic acid;2-(4-piperidin-4-ylpiperidin-1-yl)quinoline-4-carboxamide
CID 163333548

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide?
The IUPAC name of 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide (CID 97224305) is 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide.
What is the SMILES notation for 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide?
The canonical SMILES for 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide is NC(=O)c1cc(N2CCO[C@H](c3ccsc3)C2)nc2ccccc12.
What is the InChIKey of 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide?
The InChIKey is ZXFCWZSBYKPKKA-INIZCTEOSA-N. The full InChI is InChI=1S/C18H17N3O2S/c19-18(22)14-9-17(20-15-4-2-1-3-13(14)15)21-6-7-23-16(10-21)12-5-8-24-11-12/h1-5,8-9,11,16H,6-7,10H2,(H2,19,22)/t16-/m0/s1.
What are the key properties of 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide?
2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide has a molecular weight of 339.42 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-thiophen-3-ylmorpholin-4-yl]quinoline-4-carboxamide is sourced from PubChem (CID 97224305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).