7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one

C21H29N3O3 — CID 72881651

IUPAC7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1cc(=O)c(C(=O)N2CCC3(CCCN(C4CCCCC4)C3=O)C2)c[nH]1
InChIInChI=1S/C21H29N3O3/c1-15-12-18(25)17(13-22-15)19(26)23-11-9-21(14-23)8-5-10-24(20(21)27)16-6-3-2-4-7-16/h12-13,16H,2-11,14H2,1H3,(H,22,25)
InChIKeyCUCCCNZAJNGESM-UHFFFAOYSA-N
MW371.48 g/mol
LogP2.47
Rot. Bonds2

About 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one

7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 72881651) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
PubChem CID72881651
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC Name7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
SMILESCc1cc(=O)c(C(=O)N2CCC3(CCCN(C4CCCCC4)C3=O)C2)c[nH]1
InChIInChI=1S/C21H29N3O3/c1-15-12-18(25)17(13-22-15)19(26)23-11-9-21(14-23)8-5-10-24(20(21)27)16-6-3-2-4-7-16/h12-13,16H,2-11,14H2,1H3,(H,22,25)
InChIKeyCUCCCNZAJNGESM-UHFFFAOYSA-N
XLogP2.47
TPSA73.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(5,5-Dimethyl-3-oxo-cyclohex-1-enylamino)-propyl]-pyrrolidin-2-one
CID 654050
2-[(6-Ethyl-2-oxo-1,2-dihydropyridin-4-yl)carbonyl]-7-propyl-2,7-diazaspiro[4.5]decan-6-one
CID 72862022
(5S)-7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97128860
(5S)-7-cyclopentyl-2-(2-methyl-6-oxo-1H-pyridine-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97197236
7,7-dimethyl-3-(piperidin-1-ylcarbonyl)-7,8-dihydroquinoline-2,5(1H,6H)-dione
CID 17020151
7-(2,2-dimethylpropyl)-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 56888151
5-{[7-(Cyclobutylmethyl)-2,7-diazaspiro[4.5]dec-2-yl]carbonyl}-2-methyl-4-pyridinol
CID 56905879
2-[(2-Hydroxy-5,6,7,8-tetrahydro-3-quinolinyl)carbonyl]-7-isopropyl-2,7-diazaspiro[4.5]decan-6-one
CID 72913106
N-[(1-cyclohexylpiperidin-3-yl)methyl]-1,6-dimethyl-4-oxo-1,4-dihydropyridine-3-carboxamide
CID 118772120
5-[4-[(3S)-1-(2,2-dimethylpropyl)pyrrolidin-3-yl]piperidine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 28070674
5-[4-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-3-yl]piperidine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 28070678
5-({4-[1-(2,2-Dimethylpropyl)-3-pyrrolidinyl]-1-piperidinyl}carbonyl)-2-methyl-4-pyridinol
CID 45168966

Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one (CID 72881651) is 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one is Cc1cc(=O)c(C(=O)N2CCC3(CCCN(C4CCCCC4)C3=O)C2)c[nH]1.
What is the InChIKey of 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is CUCCCNZAJNGESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-15-12-18(25)17(13-22-15)19(26)23-11-9-21(14-23)8-5-10-24(20(21)27)16-6-3-2-4-7-16/h12-13,16H,2-11,14H2,1H3,(H,22,25).
What are the key properties of 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one?
7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 371.48 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-2-(6-methyl-4-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 72881651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).