8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine

C15H19FN2O — CID 133368255

IUPAC8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine
SMILESCOC(C)(C)CNc1cc(C)nc2c(F)cccc12
InChIInChI=1S/C15H19FN2O/c1-10-8-13(17-9-15(2,3)19-4)11-6-5-7-12(16)14(11)18-10/h5-8H,9H2,1-4H3,(H,17,18)
InChIKeyXZYDBBIEVRGXPA-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.52
Rot. Bonds4

About 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine

8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine (PubChem CID 133368255) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine
PubChem CID133368255
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine
SMILESCOC(C)(C)CNc1cc(C)nc2c(F)cccc12
InChIInChI=1S/C15H19FN2O/c1-10-8-13(17-9-15(2,3)19-4)11-6-5-7-12(16)14(11)18-10/h5-8H,9H2,1-4H3,(H,17,18)
InChIKeyXZYDBBIEVRGXPA-UHFFFAOYSA-N
XLogP3.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(8-fluoro-2-methylquinolin-4-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 122060920
1-[(8-fluoro-2-methylquinolin-4-yl)amino]-3-methoxypropan-2-ol
CID 133394041
1-[(8-fluoro-2-methylquinolin-4-yl)amino]-2-thiophen-2-ylpropan-2-ol
CID 133394254
6-[(8-fluoro-2-methylquinolin-4-yl)amino]hexan-1-ol
CID 133434482
8-fluoro-2-methyl-N-[4-(1,2,4-triazol-4-yl)butyl]quinolin-4-amine
CID 133368296
3-[[(8-fluoro-2-methylquinolin-4-yl)amino]methyl]pentan-1-ol
CID 133368901
8-methoxy-N-(4-methoxy-2,2-dimethylbutyl)-2-methylquinolin-4-amine
CID 133459634
8-fluoro-2-methyl-N-[2-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]quinolin-4-amine
CID 133394032
8-fluoro-2-methyl-N-(2-methyl-3-morpholin-4-ylpropyl)quinolin-4-amine
CID 133394200
N-[(8-fluoro-2-methylquinolin-4-yl)methyl]-2-methoxyethanamine
CID 82448807
N-but-3-en-2-yl-8-fluoro-2-methylquinolin-4-amine
CID 133369006
2-[(8-fluoro-2-methylquinolin-4-yl)amino]-1-(oxan-4-yl)ethanol
CID 133394132

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine?
The IUPAC name of 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine (CID 133368255) is 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine.
What is the SMILES notation for 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine?
The canonical SMILES for 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine is COC(C)(C)CNc1cc(C)nc2c(F)cccc12.
What is the InChIKey of 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine?
The InChIKey is XZYDBBIEVRGXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-10-8-13(17-9-15(2,3)19-4)11-6-5-7-12(16)14(11)18-10/h5-8H,9H2,1-4H3,(H,17,18).
What are the key properties of 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine?
8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine has a molecular weight of 262.33 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N-(2-methoxy-2-methylpropyl)-2-methylquinolin-4-amine is sourced from PubChem (CID 133368255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).