3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide

C17H23FN2O2 — CID 71929869

IUPAC3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide
SMILESCC(C)C(C)NC(=O)CCN1C(=O)CCc2cc(F)ccc21
InChIInChI=1S/C17H23FN2O2/c1-11(2)12(3)19-16(21)8-9-20-15-6-5-14(18)10-13(15)4-7-17(20)22/h5-6,10-12H,4,7-9H2,1-3H3,(H,19,21)
InChIKeyNEPQMQLLNPBGEX-UHFFFAOYSA-N
MW306.38 g/mol
LogP2.66
Rot. Bonds5

About 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide

3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide (PubChem CID 71929869) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide
PubChem CID71929869
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC Name3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide
SMILESCC(C)C(C)NC(=O)CCN1C(=O)CCc2cc(F)ccc21
InChIInChI=1S/C17H23FN2O2/c1-11(2)12(3)19-16(21)8-9-20-15-6-5-14(18)10-13(15)4-7-17(20)22/h5-6,10-12H,4,7-9H2,1-3H3,(H,19,21)
InChIKeyNEPQMQLLNPBGEX-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide?
The IUPAC name of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide (CID 71929869) is 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide.
What is the SMILES notation for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide?
The canonical SMILES for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide is CC(C)C(C)NC(=O)CCN1C(=O)CCc2cc(F)ccc21.
What is the InChIKey of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide?
The InChIKey is NEPQMQLLNPBGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c1-11(2)12(3)19-16(21)8-9-20-15-6-5-14(18)10-13(15)4-7-17(20)22/h5-6,10-12H,4,7-9H2,1-3H3,(H,19,21).
What are the key properties of 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide?
3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide has a molecular weight of 306.38 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(3-methylbutan-2-yl)propanamide is sourced from PubChem (CID 71929869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).