8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine

C19H23FN2O — CID 133377639

IUPAC8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
SMILESCc1cc(NC2CCOC3(CCCC3)C2)c2cccc(F)c2n1
InChIInChI=1S/C19H23FN2O/c1-13-11-17(15-5-4-6-16(20)18(15)21-13)22-14-7-10-23-19(12-14)8-2-3-9-19/h4-6,11,14H,2-3,7-10,12H2,1H3,(H,21,22)
InChIKeyMAVXTXIUNKGHOZ-UHFFFAOYSA-N
MW314.40 g/mol
LogP4.59
Rot. Bonds2

About 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine

8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine (PubChem CID 133377639) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
PubChem CID133377639
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
SMILESCc1cc(NC2CCOC3(CCCC3)C2)c2cccc(F)c2n1
InChIInChI=1S/C19H23FN2O/c1-13-11-17(15-5-4-6-16(20)18(15)21-13)22-14-7-10-23-19(12-14)8-2-3-9-19/h4-6,11,14H,2-3,7-10,12H2,1H3,(H,21,22)
InChIKeyMAVXTXIUNKGHOZ-UHFFFAOYSA-N
XLogP4.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine with MolForge

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Related Compounds

8-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine
CID 133377787
N-naphthalen-1-yl-6-oxaspiro[4.5]decan-9-amine
CID 79901355
N-(5-fluoro-2-methylphenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898100
N-(3-fluoro-2-nitrophenyl)-6-oxaspiro[4.5]decan-9-amine
CID 133377810
8-fluoro-2-methyl-N-(3-methylsulfonylcyclohexyl)quinolin-4-amine
CID 133394333
N-(2,3-dimethylphenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79897570
N-(2-methylsulfanylphenyl)-6-oxaspiro[4.5]decan-9-amine
CID 107644684
N-(3-fluoro-2-methylphenyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79895167
N-(2,4-dimethylphenyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79898292
4-methyl-N-[(9R)-6-oxaspiro[4.5]decan-9-yl]pyrimidin-2-amine
CID 97234618
N-(4-bromo-2-fluorophenyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79897853
2-(methoxymethyl)-6-methyl-N-[(9S)-6-oxaspiro[4.5]decan-9-yl]pyrimidin-4-amine
CID 97234627

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The IUPAC name of 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine (CID 133377639) is 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine.
What is the SMILES notation for 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The canonical SMILES for 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine is Cc1cc(NC2CCOC3(CCCC3)C2)c2cccc(F)c2n1.
What is the InChIKey of 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
The InChIKey is MAVXTXIUNKGHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-13-11-17(15-5-4-6-16(20)18(15)21-13)22-14-7-10-23-19(12-14)8-2-3-9-19/h4-6,11,14H,2-3,7-10,12H2,1H3,(H,21,22).
What are the key properties of 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine?
8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine has a molecular weight of 314.40 g/mol, XLogP of 4.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-N-(6-oxaspiro[4.5]decan-9-yl)quinolin-4-amine is sourced from PubChem (CID 133377639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).