3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride

C18H22ClN3O2 — CID 154889705

IUPAC3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride
SMILESCl.O=C(c1cc2ccccc2[nH]c1=O)N1CCC2(CCCNC2)C1
InChIInChI=1S/C18H21N3O2.ClH/c22-16-14(10-13-4-1-2-5-15(13)20-16)17(23)21-9-7-18(12-21)6-3-8-19-11-18;/h1-2,4-5,10,19H,3,6-9,11-12H2,(H,20,22);1H
InChIKeyFPOCFDZYDRGTOG-UHFFFAOYSA-N
MW347.85 g/mol
LogP2.17
Rot. Bonds1

About 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride

3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride (PubChem CID 154889705) has the molecular formula C18H22ClN3O2 and a molecular weight of 347.85 g/mol. Its IUPAC name is 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride.

Molecular Properties

Compound Name3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride
PubChem CID154889705
Molecular FormulaC18H22ClN3O2
Molecular Weight347.85 g/mol
Exact Mass347.14
IUPAC Name3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride
SMILESCl.O=C(c1cc2ccccc2[nH]c1=O)N1CCC2(CCCNC2)C1
InChIInChI=1S/C18H21N3O2.ClH/c22-16-14(10-13-4-1-2-5-15(13)20-16)17(23)21-9-7-18(12-21)6-3-8-19-11-18;/h1-2,4-5,10,19H,3,6-9,11-12H2,(H,20,22);1H
InChIKeyFPOCFDZYDRGTOG-UHFFFAOYSA-N
XLogP2.17
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.85
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one
CID 56752764
2,9-diazaspiro[4.5]decan-2-yl-(2,8-dimethylquinolin-3-yl)methanone;dihydrochloride
CID 154890513
3-(2,8-diazaspiro[5.5]undecane-2-carbonyl)-1H-pyridin-2-one
CID 102849780
[(5S)-2,9-diazaspiro[4.5]decan-2-yl]-(2,4,5-trimethylphenyl)methanone
CID 95217985
2,9-diazaspiro[4.5]decan-2-yl-(2,4,5-trimethylphenyl)methanone
CID 56754594
2,9-diazaspiro[4.5]decan-2-yl-(4-methyl-2-phenylpyrimidin-5-yl)methanone
CID 56742818
(2-chlorophenyl)-(2,7-diazaspiro[4.4]nonan-2-yl)methanone
CID 82038205
(2-benzyl-1,3-thiazol-4-yl)-(2,9-diazaspiro[4.5]decan-2-yl)methanone;hydrochloride
CID 154889666
3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1,6-dimethylquinolin-4-one;hydrochloride
CID 154885407
3-(4-methylpiperidine-1-carbonyl)-1H-quinolin-2-one
CID 16589973
2,7-diazaspiro[4.4]nonan-2-yl-(2-fluorophenyl)methanone
CID 82038235
2,9-diazaspiro[4.5]decan-2-yl(2,3-dihydro-1-benzofuran-7-yl)methanone
CID 56750707

Frequently Asked Questions

What is the IUPAC name of 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride?
The IUPAC name of 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride (CID 154889705) is 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride.
What is the SMILES notation for 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride?
The canonical SMILES for 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride is Cl.O=C(c1cc2ccccc2[nH]c1=O)N1CCC2(CCCNC2)C1.
What is the InChIKey of 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride?
The InChIKey is FPOCFDZYDRGTOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2.ClH/c22-16-14(10-13-4-1-2-5-15(13)20-16)17(23)21-9-7-18(12-21)6-3-8-19-11-18;/h1-2,4-5,10,19H,3,6-9,11-12H2,(H,20,22);1H.
What are the key properties of 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride?
3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride has a molecular weight of 347.85 g/mol, XLogP of 2.17, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,9-diazaspiro[4.5]decane-2-carbonyl)-1H-quinolin-2-one;hydrochloride is sourced from PubChem (CID 154889705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).