6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one

C19H19FN4O3 — CID 91786288

IUPAC6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one
SMILESCc1nc(CC2CCN(C(=O)c3cc(=O)[nH]c4ccc(F)cc34)CC2)no1
InChIInChI=1S/C19H19FN4O3/c1-11-21-17(23-27-11)8-12-4-6-24(7-5-12)19(26)15-10-18(25)22-16-3-2-13(20)9-14(15)16/h2-3,9-10,12H,4-8H2,1H3,(H,22,25)
InChIKeyMDBXFVAHLUXYBV-UHFFFAOYSA-N
MW370.38 g/mol
LogP2.45
Rot. Bonds3

About 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one

6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one (PubChem CID 91786288) has the molecular formula C19H19FN4O3 and a molecular weight of 370.38 g/mol. Its IUPAC name is 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one
PubChem CID91786288
Molecular FormulaC19H19FN4O3
Molecular Weight370.38 g/mol
Exact Mass370.14
IUPAC Name6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one
SMILESCc1nc(CC2CCN(C(=O)c3cc(=O)[nH]c4ccc(F)cc34)CC2)no1
InChIInChI=1S/C19H19FN4O3/c1-11-21-17(23-27-11)8-12-4-6-24(7-5-12)19(26)15-10-18(25)22-16-3-2-13(20)9-14(15)16/h2-3,9-10,12H,4-8H2,1H3,(H,22,25)
InChIKeyMDBXFVAHLUXYBV-UHFFFAOYSA-N
XLogP2.45
TPSA92.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one with MolForge

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Launch Full Analysis

Related Compounds

6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperazine-1-carbonyl]-1H-quinolin-2-one
CID 91778645
2-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]benzonitrile
CID 91767952
(2R)-2-(2,4-difluorophenoxy)-1-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one
CID 124753479
1-(6-fluoro-2-oxo-1H-quinoline-4-carbonyl)-4-hydroxypiperidine-4-carboxylic acid
CID 56861198
6-bromo-4-[4-(methylaminomethyl)piperidine-1-carbonyl]-1H-quinolin-2-one;hydrochloride
CID 119544979
[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(2-pyridin-4-ylpyrimidin-5-yl)methanone
CID 72858587
N-[[1-(7-fluoro-2-oxo-1H-quinoline-4-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide
CID 131941647
4-[(3R)-3-[2-(4-fluorophenyl)ethyl]piperidine-1-carbonyl]-6-methyl-1H-quinolin-2-one
CID 95558519
6-fluoro-4-[4-(2-oxo-1H-pyrazin-3-yl)piperazine-1-carbonyl]-1H-quinolin-2-one
CID 77081679
6-fluoro-4-[(1R,5R)-6-propyl-3,6-diazabicyclo[3.2.2]nonane-3-carbonyl]-1H-quinolin-2-one
CID 70705153
4-(azocane-1-carbonyl)-7-fluoro-1H-quinolin-2-one
CID 71874791
1-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone
CID 91797759

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one?
The IUPAC name of 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one (CID 91786288) is 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one.
What is the SMILES notation for 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one?
The canonical SMILES for 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one is Cc1nc(CC2CCN(C(=O)c3cc(=O)[nH]c4ccc(F)cc34)CC2)no1.
What is the InChIKey of 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one?
The InChIKey is MDBXFVAHLUXYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O3/c1-11-21-17(23-27-11)8-12-4-6-24(7-5-12)19(26)15-10-18(25)22-16-3-2-13(20)9-14(15)16/h2-3,9-10,12H,4-8H2,1H3,(H,22,25).
What are the key properties of 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one?
6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one has a molecular weight of 370.38 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]-1H-quinolin-2-one is sourced from PubChem (CID 91786288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).