7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine

C16H20FN3O — CID 102955565

IUPAC7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine
SMILESCOC1CN(c2c(F)cc(N)c3cccnc23)CCC1C
InChIInChI=1S/C16H20FN3O/c1-10-5-7-20(9-14(10)21-2)16-12(17)8-13(18)11-4-3-6-19-15(11)16/h3-4,6,8,10,14H,5,7,9,18H2,1-2H3
InChIKeyQABIDROGAQTIQL-UHFFFAOYSA-N
MW289.35 g/mol
LogP2.82
Rot. Bonds2

About 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine

7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine (PubChem CID 102955565) has the molecular formula C16H20FN3O and a molecular weight of 289.35 g/mol. Its IUPAC name is 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine.

Molecular Properties

Compound Name7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine
PubChem CID102955565
Molecular FormulaC16H20FN3O
Molecular Weight289.35 g/mol
Exact Mass289.16
IUPAC Name7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine
SMILESCOC1CN(c2c(F)cc(N)c3cccnc23)CCC1C
InChIInChI=1S/C16H20FN3O/c1-10-5-7-20(9-14(10)21-2)16-12(17)8-13(18)11-4-3-6-19-15(11)16/h3-4,6,8,10,14H,5,7,9,18H2,1-2H3
InChIKeyQABIDROGAQTIQL-UHFFFAOYSA-N
XLogP2.82
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[1-(5-amino-7-fluoroquinolin-8-yl)pyrrolidin-3-yl]ethanol
CID 115964840
1-(5-amino-7-fluoroquinolin-8-yl)piperidine-4-carboxamide
CID 83163699
8-(2,5-dimethylpiperidin-1-yl)-7-fluoroquinolin-5-amine
CID 83166349
8-(3,3-dimethylpyrrolidin-1-yl)-7-fluoroquinolin-5-amine
CID 83165348
7-fluoro-8-(4-methyl-1,4-diazepan-1-yl)quinolin-5-amine
CID 83173958
7-fluoro-8-(1,4-oxazepan-4-yl)quinolin-5-amine
CID 83164110
5-fluoro-4-methoxy-2-(3-methoxy-4-methylpiperidin-1-yl)aniline
CID 102955599
1-(5-amino-7-fluoroquinolin-8-yl)-4-methylazepan-4-ol
CID 107403613
7-fluoro-8-(2-propan-2-ylpyrrolidin-1-yl)quinolin-5-amine
CID 83164118
1-(5-amino-7-fluoroquinolin-8-yl)-1,4-diazepan-5-one
CID 83164796
7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine
CID 83164133
8-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-7-fluoroquinolin-5-amine
CID 83166153

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine?
The IUPAC name of 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine (CID 102955565) is 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine.
What is the SMILES notation for 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine?
The canonical SMILES for 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine is COC1CN(c2c(F)cc(N)c3cccnc23)CCC1C.
What is the InChIKey of 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine?
The InChIKey is QABIDROGAQTIQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O/c1-10-5-7-20(9-14(10)21-2)16-12(17)8-13(18)11-4-3-6-19-15(11)16/h3-4,6,8,10,14H,5,7,9,18H2,1-2H3.
What are the key properties of 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine?
7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine has a molecular weight of 289.35 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine is sourced from PubChem (CID 102955565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).