6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline

C16H19N3 — CID 82537940

IUPAC6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline
SMILESc1cnc2ccc(N3CCC4(CCNC4)C3)cc2c1
InChIInChI=1S/C16H19N3/c1-2-13-10-14(3-4-15(13)18-7-1)19-9-6-16(12-19)5-8-17-11-16/h1-4,7,10,17H,5-6,8-9,11-12H2
InChIKeyGVTLXGIKVZVVLN-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.42
Rot. Bonds1

About 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline

6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline (PubChem CID 82537940) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline.

Molecular Properties

Compound Name6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline
PubChem CID82537940
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline
SMILESc1cnc2ccc(N3CCC4(CCNC4)C3)cc2c1
InChIInChI=1S/C16H19N3/c1-2-13-10-14(3-4-15(13)18-7-1)19-9-6-16(12-19)5-8-17-11-16/h1-4,7,10,17H,5-6,8-9,11-12H2
InChIKeyGVTLXGIKVZVVLN-UHFFFAOYSA-N
XLogP2.42
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-3-yl-2,7-diazaspiro[4.4]nonane
CID 10262309
6-(1,4-diazepan-1-yl)quinoline
CID 62635992
4-(2,7-diazaspiro[4.4]nonan-2-yl)-2-hydroxybenzaldehyde
CID 171103032
2-(3-methylphenyl)-2,7-diazaspiro[4.4]nonane
CID 117028701
2-(1,3-benzodioxol-5-yl)-2,7-diazaspiro[4.4]nonane
CID 82537950
(5S)-2-(4-methylpyrimidin-2-yl)-2,7-diazaspiro[4.4]nonane
CID 170131044
5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-oxazole
CID 10081310
6-(4-pyridin-2-ylpiperazin-1-yl)quinoline
CID 110454797
2-(2,7-diazaspiro[4.4]nonan-2-yl)-1,3-benzothiazole
CID 112740355
(5S)-2-(2-chlorophenyl)-2,7-diazaspiro[4.4]nonane
CID 96706336
2-[(5R)-2,9-diazaspiro[4.5]decan-2-yl]pyridine-3-carboxylic acid
CID 95228465
2-(2,7-diazaspiro[4.4]nonan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 112740371

Frequently Asked Questions

What is the IUPAC name of 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline?
The IUPAC name of 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline (CID 82537940) is 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline.
What is the SMILES notation for 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline?
The canonical SMILES for 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline is c1cnc2ccc(N3CCC4(CCNC4)C3)cc2c1.
What is the InChIKey of 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline?
The InChIKey is GVTLXGIKVZVVLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c1-2-13-10-14(3-4-15(13)18-7-1)19-9-6-16(12-19)5-8-17-11-16/h1-4,7,10,17H,5-6,8-9,11-12H2.
What are the key properties of 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline?
6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline has a molecular weight of 253.35 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,7-diazaspiro[4.4]nonan-2-yl)quinoline is sourced from PubChem (CID 82537940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).