3-(aminomethyl)-7-fluoro-3H-quinolin-2-one

C10H9FN2O — CID 74251623

IUPAC3-(aminomethyl)-7-fluoro-3H-quinolin-2-one
SMILESNCC1C=c2ccc(F)cc2=NC1=O
InChIInChI=1S/C10H9FN2O/c11-8-2-1-6-3-7(5-12)10(14)13-9(6)4-8/h1-4,7H,5,12H2
InChIKeyWFELMAZXWGBWQT-UHFFFAOYSA-N
MW192.19 g/mol
LogP-0.66
Rot. Bonds1

About 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one

3-(aminomethyl)-7-fluoro-3H-quinolin-2-one (PubChem CID 74251623) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one.

Molecular Properties

Compound Name3-(aminomethyl)-7-fluoro-3H-quinolin-2-one
PubChem CID74251623
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name3-(aminomethyl)-7-fluoro-3H-quinolin-2-one
SMILESNCC1C=c2ccc(F)cc2=NC1=O
InChIInChI=1S/C10H9FN2O/c11-8-2-1-6-3-7(5-12)10(14)13-9(6)4-8/h1-4,7H,5,12H2
InChIKeyWFELMAZXWGBWQT-UHFFFAOYSA-N
XLogP-0.66
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 5-0.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-difluoro-2H-quinoline-3-carboxamide
CID 141386751
3-fluoro-2H-quinoline-3-carboxamide
CID 163446550
3-(azidomethyl)-7-fluoro-3H-quinolin-2-one
CID 178188863
3-(Aminomethyl)-1,4-benzodiazepin-2-one
CID 152199547
3-[[3-(diethylamino)propylamino]methyl]-6-methyl-3H-quinolin-2-one
CID 73448527
3-[[3-(diethylamino)propylamino]methyl]-7-methyl-3H-quinolin-2-one
CID 74686682
3-(aminomethyl)-3H-quinoxalin-2-one
CID 76851164
3-amino-3H-quinolin-2-one
CID 77620786
3-(aminomethyl)-7-fluoro-3H-quinolin-2-one;hydrochloride
CID 137698478
6-(aminomethyl)-6H-quinolin-2-one
CID 178189715

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one?
The IUPAC name of 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one (CID 74251623) is 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one.
What is the SMILES notation for 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one?
The canonical SMILES for 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one is NCC1C=c2ccc(F)cc2=NC1=O.
What is the InChIKey of 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one?
The InChIKey is WFELMAZXWGBWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c11-8-2-1-6-3-7(5-12)10(14)13-9(6)4-8/h1-4,7H,5,12H2.
What are the key properties of 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one?
3-(aminomethyl)-7-fluoro-3H-quinolin-2-one has a molecular weight of 192.19 g/mol, XLogP of -0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-7-fluoro-3H-quinolin-2-one is sourced from PubChem (CID 74251623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).