[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

C18H23N5O4 — CID 131932874

IUPAC[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
SMILESCOc1nccnc1N1CCOC2(CCN(C(=O)c3cc(C)on3)CC2)C1
InChIInChI=1S/C18H23N5O4/c1-13-11-14(21-27-13)17(24)22-7-3-18(4-8-22)12-23(9-10-26-18)15-16(25-2)20-6-5-19-15/h5-6,11H,3-4,7-10,12H2,1-2H3
InChIKeyFSVZBAHXSXQIPY-UHFFFAOYSA-N
MW373.41 g/mol
LogP1.29
Rot. Bonds3

About [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (PubChem CID 131932874) has the molecular formula C18H23N5O4 and a molecular weight of 373.41 g/mol. Its IUPAC name is [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
PubChem CID131932874
Molecular FormulaC18H23N5O4
Molecular Weight373.41 g/mol
Exact Mass373.18
IUPAC Name[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
SMILESCOc1nccnc1N1CCOC2(CCN(C(=O)c3cc(C)on3)CC2)C1
InChIInChI=1S/C18H23N5O4/c1-13-11-14(21-27-13)17(24)22-7-3-18(4-8-22)12-23(9-10-26-18)15-16(25-2)20-6-5-19-15/h5-6,11H,3-4,7-10,12H2,1-2H3
InChIKeyFSVZBAHXSXQIPY-UHFFFAOYSA-N
XLogP1.29
TPSA93.82 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone with MolForge

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Related Compounds

(5-cyclopropyl-1,2-oxazol-3-yl)-(4-pyrimidin-2-yl-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl)methanone
CID 131687867
6-(5-methyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119136491
(3-methoxy-1,2-oxazol-5-yl)-(4-pyridin-2-yl-1-oxa-4,10-diazaspiro[5.6]dodecan-10-yl)methanone
CID 155876765
[(4S,5R)-4-(methoxymethyl)-6-oxa-9-azaspiro[4.5]decan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 98776933
(2,5-dimethoxyphenyl)-[2-(5-methyl-1,2-oxazole-3-carbonyl)-2,8-diazaspiro[4.5]decan-8-yl]methanone
CID 3852997
7-(3-methoxypyrazin-2-yl)-2-oxa-7-azaspiro[4.4]nonane
CID 84586688
3-amino-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 107323724
methyl 4-(5-methyl-1,2-oxazole-3-carbonyl)-1,4-diazepane-1-carboxylate
CID 110645755
tert-butyl 4-pyridin-4-yl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
CID 134394486
(1,5-dimethylpyrazol-3-yl)-[4-(3-fluoro-4-pyridinyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methanone
CID 131905519
(5-methyl-1,2-oxazol-3-yl)-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]methanone
CID 110645762
[(4S,5R)-4-(ethoxymethyl)-6-oxa-9-azaspiro[4.5]decan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 98776941

Frequently Asked Questions

What is the IUPAC name of [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The IUPAC name of [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (CID 131932874) is [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.
What is the SMILES notation for [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The canonical SMILES for [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is COc1nccnc1N1CCOC2(CCN(C(=O)c3cc(C)on3)CC2)C1.
What is the InChIKey of [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The InChIKey is FSVZBAHXSXQIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O4/c1-13-11-14(21-27-13)17(24)22-7-3-18(4-8-22)12-23(9-10-26-18)15-16(25-2)20-6-5-19-15/h5-6,11H,3-4,7-10,12H2,1-2H3.
What are the key properties of [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
[4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone has a molecular weight of 373.41 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methoxypyrazin-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 131932874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).