7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine

C15H18FN3O — CID 83164133

IUPAC7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine
SMILESCN1CCC(Oc2c(F)cc(N)c3cccnc23)CC1
InChIInChI=1S/C15H18FN3O/c1-19-7-4-10(5-8-19)20-15-12(16)9-13(17)11-3-2-6-18-14(11)15/h2-3,6,9-10H,4-5,7-8,17H2,1H3
InChIKeyOFCBSRIFWFUQHN-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.43
Rot. Bonds2

About 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine

7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine (PubChem CID 83164133) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine.

Molecular Properties

Compound Name7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine
PubChem CID83164133
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine
SMILESCN1CCC(Oc2c(F)cc(N)c3cccnc23)CC1
InChIInChI=1S/C15H18FN3O/c1-19-7-4-10(5-8-19)20-15-12(16)9-13(17)11-3-2-6-18-14(11)15/h2-3,6,9-10H,4-5,7-8,17H2,1H3
InChIKeyOFCBSRIFWFUQHN-UHFFFAOYSA-N
XLogP2.43
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.43
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

7-fluoro-8-(4-methyl-1,4-diazepan-1-yl)quinolin-5-amine
CID 83173958
7-fluoro-8-(2-piperidin-1-ylethoxy)quinolin-5-amine
CID 83164985
7-fluoro-8-(3-methoxy-4-methylpiperidin-1-yl)quinolin-5-amine
CID 102955565
7-fluoro-8-(2-propan-2-ylpyrrolidin-1-yl)quinolin-5-amine
CID 83164118
8-(2,5-dimethylpiperidin-1-yl)-7-fluoroquinolin-5-amine
CID 83166349
8-(2,5-dimethylphenoxy)-7-fluoroquinolin-5-amine
CID 83165520
8-cyclopropyloxyquinolin-5-amine
CID 156698468
1-[1-(5-amino-7-fluoroquinolin-8-yl)pyrrolidin-3-yl]ethanol
CID 115964840
8-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-7-fluoroquinolin-5-amine
CID 83166153
1-(5-amino-7-fluoroquinolin-8-yl)piperidine-4-carboxamide
CID 83163699
4-ethoxy-5-fluoro-2-(1-methylpiperidin-4-yl)oxyaniline
CID 63592899
7-fluoro-8-(2-iodophenoxy)quinolin-5-amine
CID 83165526

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine?
The IUPAC name of 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine (CID 83164133) is 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine.
What is the SMILES notation for 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine?
The canonical SMILES for 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine is CN1CCC(Oc2c(F)cc(N)c3cccnc23)CC1.
What is the InChIKey of 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine?
The InChIKey is OFCBSRIFWFUQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-19-7-4-10(5-8-19)20-15-12(16)9-13(17)11-3-2-6-18-14(11)15/h2-3,6,9-10H,4-5,7-8,17H2,1H3.
What are the key properties of 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine?
7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine has a molecular weight of 275.33 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-8-(1-methylpiperidin-4-yl)oxyquinolin-5-amine is sourced from PubChem (CID 83164133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).