6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide

C15H20FN3O2 — CID 60860353

IUPAC6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide
SMILESNC(=O)CCCCC(N)c1cc2c(cc1F)NC(=O)CC2
InChIInChI=1S/C15H20FN3O2/c16-11-8-13-9(5-6-15(21)19-13)7-10(11)12(17)3-1-2-4-14(18)20/h7-8,12H,1-6,17H2,(H2,18,20)(H,19,21)
InChIKeySEBOEHWDCPHMGK-UHFFFAOYSA-N
MW293.34 g/mol
LogP1.76
Rot. Bonds6

About 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide

6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide (PubChem CID 60860353) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide.

Molecular Properties

Compound Name6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide
PubChem CID60860353
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC Name6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide
SMILESNC(=O)CCCCC(N)c1cc2c(cc1F)NC(=O)CC2
InChIInChI=1S/C15H20FN3O2/c16-11-8-13-9(5-6-15(21)19-13)7-10(11)12(17)3-1-2-4-14(18)20/h7-8,12H,1-6,17H2,(H2,18,20)(H,19,21)
InChIKeySEBOEHWDCPHMGK-UHFFFAOYSA-N
XLogP1.76
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide 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-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide?
The IUPAC name of 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide (CID 60860353) is 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide.
What is the SMILES notation for 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide?
The canonical SMILES for 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide is NC(=O)CCCCC(N)c1cc2c(cc1F)NC(=O)CC2.
What is the InChIKey of 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide?
The InChIKey is SEBOEHWDCPHMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c16-11-8-13-9(5-6-15(21)19-13)7-10(11)12(17)3-1-2-4-14(18)20/h7-8,12H,1-6,17H2,(H2,18,20)(H,19,21).
What are the key properties of 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide?
6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide has a molecular weight of 293.34 g/mol, XLogP of 1.76, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-6-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)hexanamide is sourced from PubChem (CID 60860353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).