2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one

C16H13FN2O — CID 129262475

IUPAC2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one
SMILESNCc1cc2ccc(F)cn2c(=O)c1-c1ccccc1
InChIInChI=1S/C16H13FN2O/c17-13-6-7-14-8-12(9-18)15(16(20)19(14)10-13)11-4-2-1-3-5-11/h1-8,10H,9,18H2
InChIKeyIZRNXZMPRAZZRZ-UHFFFAOYSA-N
MW268.29 g/mol
LogP2.56
Rot. Bonds2

About 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one

2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one (PubChem CID 129262475) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one.

Molecular Properties

Compound Name2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one
PubChem CID129262475
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one
SMILESNCc1cc2ccc(F)cn2c(=O)c1-c1ccccc1
InChIInChI=1S/C16H13FN2O/c17-13-6-7-14-8-12(9-18)15(16(20)19(14)10-13)11-4-2-1-3-5-11/h1-8,10H,9,18H2
InChIKeyIZRNXZMPRAZZRZ-UHFFFAOYSA-N
XLogP2.56
TPSA47.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(7-fluoro-4-oxo-3-phenylquinolizin-2-yl)ethyl carbamate
CID 129248923
2-(2-aminoethyl)-7-fluoro-3-(3-fluorophenyl)quinolizin-4-one
CID 118627701
(S)-4-(7-fluoro-4-oxo-3-phenylquinolizin-2-yl)-2-methylpentane-2-sulfinamide
CID 140786719
2-[(1S)-1-aminoethyl]-7-fluoro-1-(4-fluorophenyl)-3-phenylquinolizin-4-one
CID 129262395
2-[(1R)-1-[(6-amino-5-isocyanopyrimidin-4-yl)amino]propyl]-7-fluoro-3-phenylquinolizin-4-one
CID 140786700
2-[(1S)-1-aminoethyl]-7-fluoro-1-methyl-3-phenylquinolizin-4-one
CID 129262508
(4-fluoro-2-phenylphenyl)methanamine
CID 46314898
2-[1-[4-amino-5-(3-fluoro-5-hydroxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]ethyl]-7-fluoro-3-phenylquinolizin-4-one
CID 118630945
2-[1-[4-amino-3-(6-oxo-1H-pyridin-3-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-7-fluoro-3-phenylquinolizin-4-one
CID 136959659
1-ethyl-7-fluoro-3-phenyl-2-(2H-pyrimidin-1-yl)quinolizin-4-one
CID 118627682
2-[(2-chloro-4-fluorophenyl)methyl]-4,5-diphenyl-1H-pyrazol-3-one
CID 22769165
N-[3-[4-amino-1-[1-(7-fluoro-4-oxo-3-phenylquinolizin-2-yl)ethyl]pyrazolo[3,4-d]pyrimidin-3-yl]-5-fluorophenyl]methanesulfonamide
CID 118627660

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one?
The IUPAC name of 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one (CID 129262475) is 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one.
What is the SMILES notation for 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one?
The canonical SMILES for 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one is NCc1cc2ccc(F)cn2c(=O)c1-c1ccccc1.
What is the InChIKey of 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one?
The InChIKey is IZRNXZMPRAZZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c17-13-6-7-14-8-12(9-18)15(16(20)19(14)10-13)11-4-2-1-3-5-11/h1-8,10H,9,18H2.
What are the key properties of 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one?
2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one has a molecular weight of 268.29 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-7-fluoro-3-phenylquinolizin-4-one is sourced from PubChem (CID 129262475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).