6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one

C15H21FN2O — CID 43493677

IUPAC6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
SMILESCCCC(NCC)c1cc2c(cc1F)NC(=O)CC2
InChIInChI=1S/C15H21FN2O/c1-3-5-13(17-4-2)11-8-10-6-7-15(19)18-14(10)9-12(11)16/h8-9,13,17H,3-7H2,1-2H3,(H,18,19)
InChIKeyAKTLWVCCEFBESC-UHFFFAOYSA-N
MW264.34 g/mol
LogP3.16
Rot. Bonds5

About 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one

6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43493677) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
PubChem CID43493677
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
SMILESCCCC(NCC)c1cc2c(cc1F)NC(=O)CC2
InChIInChI=1S/C15H21FN2O/c1-3-5-13(17-4-2)11-8-10-6-7-15(19)18-14(10)9-12(11)16/h8-9,13,17H,3-7H2,1-2H3,(H,18,19)
InChIKeyAKTLWVCCEFBESC-UHFFFAOYSA-N
XLogP3.16
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one with MolForge

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Related Compounds

7-fluoro-6-[4-methyl-1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one
CID 43487524
6-(1-amino-2-methylpentyl)-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 43457682
6-[1-(ethylamino)butyl]-3,4-dihydro-1H-quinolin-2-one
CID 43490895
6-[2-cyclopropyl-1-(ethylamino)propyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 83149790
7-fluoro-6-[3-methyl-1-(methylamino)butyl]-3,4-dihydro-1H-quinolin-2-one
CID 43487531
6-fluoro-7-(heptan-4-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43723940
6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide
CID 60860353
6-chloro-5-[1-(ethylamino)pentyl]-1,3-dihydroindol-2-one
CID 43493705
6-fluoro-7-(heptan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43723883
6-[chloro-(2-methylcyclopentyl)methyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 107182090
6-bromo-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 43457689
6-(chloromethyl)-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 43457700

Frequently Asked Questions

What is the IUPAC name of 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one (CID 43493677) is 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one is CCCC(NCC)c1cc2c(cc1F)NC(=O)CC2.
What is the InChIKey of 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is AKTLWVCCEFBESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-3-5-13(17-4-2)11-8-10-6-7-15(19)18-14(10)9-12(11)16/h8-9,13,17H,3-7H2,1-2H3,(H,18,19).
What are the key properties of 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one?
6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 264.34 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(ethylamino)butyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43493677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).