7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide

C20H20FN3O4 — CID 110621241

IUPAC7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCOCC1)c1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C20H20FN3O4/c21-14-4-3-13-10-15(20(26)23-16(13)11-14)19(25)22-12-17(18-2-1-7-28-18)24-5-8-27-9-6-24/h1-4,7,10-11,17H,5-6,8-9,12H2,(H,22,25)(H,23,26)
InChIKeyVZGXELAQVFTVQS-UHFFFAOYSA-N
MW385.40 g/mol
LogP2.06
Rot. Bonds5

About 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide

7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 110621241) has the molecular formula C20H20FN3O4 and a molecular weight of 385.40 g/mol. Its IUPAC name is 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide
PubChem CID110621241
Molecular FormulaC20H20FN3O4
Molecular Weight385.40 g/mol
Exact Mass385.14
IUPAC Name7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCOCC1)c1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C20H20FN3O4/c21-14-4-3-13-10-15(20(26)23-16(13)11-14)19(25)22-12-17(18-2-1-7-28-18)24-5-8-27-9-6-24/h1-4,7,10-11,17H,5-6,8-9,12H2,(H,22,25)(H,23,26)
InChIKeyVZGXELAQVFTVQS-UHFFFAOYSA-N
XLogP2.06
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide with MolForge

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Related Compounds

3-bromo-5-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 110621303
N-[(4-fluorophenyl)methyl]-N'-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]oxamide
CID 7217195
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 110621275
(2R)-2-(4-fluorophenoxy)-N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 35128117
3-chloro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 16809743
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 42886342
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-6-methyl-1H-indole-2-carboxamide
CID 55559687
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbenzamide;hydrochloride
CID 52984760
7-fluoro-2-methyl-N-(2-morpholin-4-yl-2-phenylethyl)quinoline-3-carboxamide
CID 46569951
N'-[(2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethyl]-N-(2-methylpropyl)oxamide
CID 7162865
N-[(2R)-2-(furan-2-yl)-2-morpholin-4-ylethyl]-1,3-benzodioxole-5-carboxamide
CID 7217379
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 2542030

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide (CID 110621241) is 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide is O=C(NCC(c1ccco1)N1CCOCC1)c1cc2ccc(F)cc2[nH]c1=O.
What is the InChIKey of 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is VZGXELAQVFTVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN3O4/c21-14-4-3-13-10-15(20(26)23-16(13)11-14)19(25)22-12-17(18-2-1-7-28-18)24-5-8-27-9-6-24/h1-4,7,10-11,17H,5-6,8-9,12H2,(H,22,25)(H,23,26).
What are the key properties of 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide?
7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 385.40 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 110621241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).