4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one

C19H25N3O2 — CID 136567423

IUPAC4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCN1CCC2(CC1)CCN2C(=O)CC1CC(=O)Nc2ccccc21
InChIInChI=1S/C19H25N3O2/c1-21-9-6-19(7-10-21)8-11-22(19)18(24)13-14-12-17(23)20-16-5-3-2-4-15(14)16/h2-5,14H,6-13H2,1H3,(H,20,23)
InChIKeyKGTGNPPIRMVVOH-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.20
Rot. Bonds2

About 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one

4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 136567423) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID136567423
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCN1CCC2(CC1)CCN2C(=O)CC1CC(=O)Nc2ccccc21
InChIInChI=1S/C19H25N3O2/c1-21-9-6-19(7-10-21)8-11-22(19)18(24)13-14-12-17(23)20-16-5-3-2-4-15(14)16/h2-5,14H,6-13H2,1H3,(H,20,23)
InChIKeyKGTGNPPIRMVVOH-UHFFFAOYSA-N
XLogP2.20
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one with MolForge

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Related Compounds

4-(2-chloroethyl)-3,4-dihydro-1H-quinolin-2-one
CID 14624973
4-(4-methyl-1,4-diazepane-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 78835890
N-ethyl-N-(furan-3-ylmethyl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide
CID 136563314
4-[[2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetyl]amino]-5-phenylpentanoic acid
CID 154869426
4-[2-[7-[(2,6-difluorophenyl)methoxy]-2,5-dimethylpyrazolo[1,5-a]pyridin-3-yl]-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one
CID 146930452
N-butan-2-yl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 4616929
cis-(1R,3S)-1-amino-3-hydroxy-2,2-dimethyl-N-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]cyclobutane-1-carboxamide
CID 166355069
N-(1-cyclobutylpyrazol-4-yl)-2-(2-oxo-3,4-dihydro-1H-quinolin-4-yl)acetamide
CID 136567356
N-methyl-2-oxo-N-(2-piperidin-1-ylethyl)-3,4-dihydro-1H-quinoline-4-carboxamide
CID 46966420
1-cycloheptyl-1-methyl-3-[(2-oxo-3,4-dihydro-1H-quinolin-4-yl)methyl]urea
CID 71977247
(4R)-4-[[[(2S)-5-hydroxypentan-2-yl]amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 99781975
4-[[1-(furan-2-yl)ethylamino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 84588587

Frequently Asked Questions

What is the IUPAC name of 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one (CID 136567423) is 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one is CN1CCC2(CC1)CCN2C(=O)CC1CC(=O)Nc2ccccc21.
What is the InChIKey of 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is KGTGNPPIRMVVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-21-9-6-19(7-10-21)8-11-22(19)18(24)13-14-12-17(23)20-16-5-3-2-4-15(14)16/h2-5,14H,6-13H2,1H3,(H,20,23).
What are the key properties of 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one?
4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 327.43 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(7-methyl-1,7-diazaspiro[3.5]nonan-1-yl)-2-oxoethyl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 136567423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).