6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one

C19H19FN4O3 — CID 74234289

IUPAC6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCC(Oc3ncccn3)CC2)c2cc(F)ccc2N1
InChIInChI=1S/C19H19FN4O3/c20-12-2-3-16-14(10-12)15(11-17(25)23-16)18(26)24-8-4-13(5-9-24)27-19-21-6-1-7-22-19/h1-3,6-7,10,13,15H,4-5,8-9,11H2,(H,23,25)
InChIKeyOOROERZPFLXRPY-UHFFFAOYSA-N
MW370.38 g/mol
LogP2.11
Rot. Bonds3

About 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one

6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 74234289) has the molecular formula C19H19FN4O3 and a molecular weight of 370.38 g/mol. Its IUPAC name is 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID74234289
Molecular FormulaC19H19FN4O3
Molecular Weight370.38 g/mol
Exact Mass370.14
IUPAC Name6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCC(Oc3ncccn3)CC2)c2cc(F)ccc2N1
InChIInChI=1S/C19H19FN4O3/c20-12-2-3-16-14(10-12)15(11-17(25)23-16)18(26)24-8-4-13(5-9-24)27-19-21-6-1-7-22-19/h1-3,6-7,10,13,15H,4-5,8-9,11H2,(H,23,25)
InChIKeyOOROERZPFLXRPY-UHFFFAOYSA-N
XLogP2.11
TPSA84.42 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 ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one (CID 74234289) is 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CC(C(=O)N2CCC(Oc3ncccn3)CC2)c2cc(F)ccc2N1.
What is the InChIKey of 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is OOROERZPFLXRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O3/c20-12-2-3-16-14(10-12)15(11-17(25)23-16)18(26)24-8-4-13(5-9-24)27-19-21-6-1-7-22-19/h1-3,6-7,10,13,15H,4-5,8-9,11H2,(H,23,25).
What are the key properties of 6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
6-fluoro-4-(4-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 370.38 g/mol, XLogP of 2.11, 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-pyrimidin-2-yloxypiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 74234289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).