8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane

C19H24FN3O — CID 157040955

IUPAC8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCOc1cc2nccc(N3CCC4(CCN(C)C4)CC3)c2cc1F
InChIInChI=1S/C19H24FN3O/c1-22-8-4-19(13-22)5-9-23(10-6-19)17-3-7-21-16-12-18(24-2)15(20)11-14(16)17/h3,7,11-12H,4-6,8-10,13H2,1-2H3
InChIKeyNAHKWBUQZSBMKB-UHFFFAOYSA-N
MW329.42 g/mol
LogP3.30
Rot. Bonds2

About 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane

8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane (PubChem CID 157040955) has the molecular formula C19H24FN3O and a molecular weight of 329.42 g/mol. Its IUPAC name is 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane
PubChem CID157040955
Molecular FormulaC19H24FN3O
Molecular Weight329.42 g/mol
Exact Mass329.19
IUPAC Name8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane
SMILESCOc1cc2nccc(N3CCC4(CCN(C)C4)CC3)c2cc1F
InChIInChI=1S/C19H24FN3O/c1-22-8-4-19(13-22)5-9-23(10-6-19)17-3-7-21-16-12-18(24-2)15(20)11-14(16)17/h3,7,11-12H,4-6,8-10,13H2,1-2H3
InChIKeyNAHKWBUQZSBMKB-UHFFFAOYSA-N
XLogP3.30
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane with MolForge

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Related Compounds

tert-butyl 8-(6-fluoro-7-methoxyquinolin-4-yl)-2,8-diazaspiro[4.5]decane-2-carboxylate
CID 157041209
1-(7-fluoro-6-methoxyquinolin-4-yl)-3-methylpyrrolidine-3-carboxylic acid
CID 122052611
6,7-dimethoxy-4-(4-methoxypiperidin-1-yl)quinoline
CID 122152929
7-fluoro-6-methoxy-4-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]quinoline
CID 166222667
[1-[1-(6,7-dimethoxyquinolin-4-yl)piperidin-4-yl]cyclopropyl]methanamine
CID 155125344
1-(6,7-dimethoxyquinolin-4-yl)piperidine-4-carboxylic acid
CID 155125461
7-[2-[6-(azetidin-1-yl)-3-pyridinyl]-6-fluoro-7-methoxyquinolin-4-yl]-3-methyl-2λ6-thia-3,7-diazaspiro[4.4]nonane 2,2-dioxide
CID 177173104
N-[[1-[4-(6,7-dimethoxyquinolin-4-yl)piperazin-1-yl]cyclopropyl]methyl]methanesulfonamide
CID 155618197
1-[2-[1-(6,7-dimethoxyquinolin-4-yl)piperidin-4-yl]propyl]cyclopropan-1-amine
CID 175689164
2-[4-[4-(2,2-dioxo-2λ6-thia-7-azaspiro[3.4]octan-7-yl)-6-fluoro-7-methoxyquinolin-2-yl]phenoxy]-N,N-dimethylethanamine
CID 177173101
2-[1-(6,7-dimethoxyquinolin-4-yl)azetidin-3-yl]ethanamine
CID 163275209
1-(7-fluoro-6-methoxyisoquinolin-1-yl)-3-methylpyrrolidine-3-carboxylic acid
CID 122052635

Frequently Asked Questions

What is the IUPAC name of 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane (CID 157040955) is 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane is COc1cc2nccc(N3CCC4(CCN(C)C4)CC3)c2cc1F.
What is the InChIKey of 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane?
The InChIKey is NAHKWBUQZSBMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O/c1-22-8-4-19(13-22)5-9-23(10-6-19)17-3-7-21-16-12-18(24-2)15(20)11-14(16)17/h3,7,11-12H,4-6,8-10,13H2,1-2H3.
What are the key properties of 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane?
8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane has a molecular weight of 329.42 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-fluoro-7-methoxyquinolin-4-yl)-2-methyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 157040955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).