9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one

C19H21N3O2 — CID 162633720

IUPAC9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCN1CCCC2(CCCN2C(=O)c2ccc3ncccc3c2)C1=O
InChIInChI=1S/C19H21N3O2/c1-21-11-3-8-19(18(21)24)9-4-12-22(19)17(23)15-6-7-16-14(13-15)5-2-10-20-16/h2,5-7,10,13H,3-4,8-9,11-12H2,1H3
InChIKeyLUYQMRJRAOCLDL-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.46
Rot. Bonds1

About 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one

9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162633720) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162633720
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCN1CCCC2(CCCN2C(=O)c2ccc3ncccc3c2)C1=O
InChIInChI=1S/C19H21N3O2/c1-21-11-3-8-19(18(21)24)9-4-12-22(19)17(23)15-6-7-16-14(13-15)5-2-10-20-16/h2,5-7,10,13H,3-4,8-9,11-12H2,1H3
InChIKeyLUYQMRJRAOCLDL-UHFFFAOYSA-N
XLogP2.46
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-methyl-1-(4-phenylbenzoyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162635147
(6R)-1-methyl-8-(quinoline-6-carbonyl)-1,8-diazaspiro[5.5]undecan-2-one
CID 97495370
1-(3,5-difluorobenzoyl)-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 162629447
9-methyl-1-(5-methylpyridine-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 163316091
1-(1-tert-butylpyrrole-3-carbonyl)-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 163309328
ethane;quinoline-6-carboxylic acid
CID 91364452
[4-methyl-4-(methylamino)piperidin-1-yl]-quinolin-6-ylmethanone
CID 115304563
2-tert-butylsulfanyl-1-quinolin-6-ylethanone
CID 81219969
2-methyl-2-piperidin-1-yl-1-quinolin-6-ylpropan-1-one
CID 81198324
9-methyl-1-[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162629499
[(2R)-2-methylpiperazin-1-yl]-quinolin-6-ylmethanone
CID 82705265
[(1S,5S)-1-(5-methyl-1,3,4-oxadiazol-2-yl)-2-azabicyclo[3.2.0]heptan-2-yl]-quinolin-6-ylmethanone
CID 146112740

Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one (CID 162633720) is 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one is CN1CCCC2(CCCN2C(=O)c2ccc3ncccc3c2)C1=O.
What is the InChIKey of 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is LUYQMRJRAOCLDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-21-11-3-8-19(18(21)24)9-4-12-22(19)17(23)15-6-7-16-14(13-15)5-2-10-20-16/h2,5-7,10,13H,3-4,8-9,11-12H2,1H3.
What are the key properties of 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one?
9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 323.40 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162633720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).