8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one

C20H30N4O2 — CID 16739716

IUPAC8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCc1cnc(C)c(N2CCC3(CC2)CCN(C2CCC(O)CC2)C3=O)n1
InChIInChI=1S/C20H30N4O2/c1-14-13-21-15(2)18(22-14)23-10-7-20(8-11-23)9-12-24(19(20)26)16-3-5-17(25)6-4-16/h13,16-17,25H,3-12H2,1-2H3
InChIKeyOYWSPJRGIOOMLE-UHFFFAOYSA-N
MW358.49 g/mol
LogP2.22
Rot. Bonds2

About 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one

8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 16739716) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one
PubChem CID16739716
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC Name8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one
SMILESCc1cnc(C)c(N2CCC3(CC2)CCN(C2CCC(O)CC2)C3=O)n1
InChIInChI=1S/C20H30N4O2/c1-14-13-21-15(2)18(22-14)23-10-7-20(8-11-23)9-12-24(19(20)26)16-3-5-17(25)6-4-16/h13,16-17,25H,3-12H2,1-2H3
InChIKeyOYWSPJRGIOOMLE-UHFFFAOYSA-N
XLogP2.22
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,6-dimethylpyrazin-2-yl)-7-(tetrahydro-2H-pyran-4-yl)-2,7-diazaspiro[4.5]decan-6-one
CID 72843219
2-(3-methyl-2-pyrazinyl)-7-(tetrahydro-2H-pyran-4-yl)-2,7-diazaspiro[4.5]decan-6-one
CID 72937531
3-[2-(4-Hydroxycyclohexyl)-1-oxo-2,8-diazaspiro[4.5]decan-8-yl]pyrazine-2-carbonitrile
CID 16739627
2-(4-Hydroxycyclohexyl)-8-pyrazin-2-yl-2,8-diazaspiro[4.5]decan-1-one
CID 16739687
8-(6-Chloropyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one
CID 16739715
[1-(3,6-Dimethylpyrazin-2-yl)piperidin-4-yl]-(3-hydroxypyrrolidin-1-yl)methanone
CID 57942023
2-(trans-4-hydroxycyclohexyl)-9-[(4-methyl-1H-imidazol-2-yl)methyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 70748580
2-(3,6-Dimethylpyrazin-2-YL)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72882000
8-(3,6-Dimethyl-2-pyrazinyl)-2-(3-methoxypropyl)-2,8-diazaspiro[4.5]decan-3-one
CID 72888045
cis-4-{[4-(3,6-Dimethylpyrazin-2-yl)piperazin-1-yl]carbonyl}cyclohexanol
CID 77081669
(5R)-2-(3,6-dimethylpyrazin-2-yl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97129014
(5S)-2-(3,6-dimethylpyrazin-2-yl)-7-(2-hydroxyethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 97129015

Frequently Asked Questions

What is the IUPAC name of 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one (CID 16739716) is 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one is Cc1cnc(C)c(N2CCC3(CC2)CCN(C2CCC(O)CC2)C3=O)n1.
What is the InChIKey of 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is OYWSPJRGIOOMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-14-13-21-15(2)18(22-14)23-10-7-20(8-11-23)9-12-24(19(20)26)16-3-5-17(25)6-4-16/h13,16-17,25H,3-12H2,1-2H3.
What are the key properties of 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one?
8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 358.49 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,6-dimethylpyrazin-2-yl)-2-(4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 16739716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).