6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one

C18H25FN2O2 — CID 175346354

IUPAC6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(CCCF)ccc2N1CCN1CCOCC1
InChIInChI=1S/C18H25FN2O2/c19-7-1-2-15-3-5-17-16(14-15)4-6-18(22)21(17)9-8-20-10-12-23-13-11-20/h3,5,14H,1-2,4,6-13H2
InChIKeyBFVJAMWNAWHLFK-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.20
Rot. Bonds6

About 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one

6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one (PubChem CID 175346354) has the molecular formula C18H25FN2O2 and a molecular weight of 320.41 g/mol. Its IUPAC name is 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
PubChem CID175346354
Molecular FormulaC18H25FN2O2
Molecular Weight320.41 g/mol
Exact Mass320.19
IUPAC Name6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(CCCF)ccc2N1CCN1CCOCC1
InChIInChI=1S/C18H25FN2O2/c19-7-1-2-15-3-5-17-16(14-15)4-6-18(22)21(17)9-8-20-10-12-23-13-11-20/h3,5,14H,1-2,4,6-13H2
InChIKeyBFVJAMWNAWHLFK-UHFFFAOYSA-N
XLogP2.20
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one (CID 175346354) is 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one is O=C1CCc2cc(CCCF)ccc2N1CCN1CCOCC1.
What is the InChIKey of 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
The InChIKey is BFVJAMWNAWHLFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O2/c19-7-1-2-15-3-5-17-16(14-15)4-6-18(22)21(17)9-8-20-10-12-23-13-11-20/h3,5,14H,1-2,4,6-13H2.
What are the key properties of 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one?
6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one has a molecular weight of 320.41 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoropropyl)-1-(2-morpholin-4-ylethyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 175346354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).