spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one

C10H13N3OS — CID 96590760

IUPACspiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one
SMILESO=C1Nc2sccc2NC12CCNCC2
InChIInChI=1S/C10H13N3OS/c14-9-10(2-4-11-5-3-10)13-7-1-6-15-8(7)12-9/h1,6,11,13H,2-5H2,(H,12,14)
InChIKeyWNKYVUJILYGSFE-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.23
Rot. Bonds

About spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one

spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one (PubChem CID 96590760) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one.

Molecular Properties

Compound Namespiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one
PubChem CID96590760
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Namespiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one
SMILESO=C1Nc2sccc2NC12CCNCC2
InChIInChI=1S/C10H13N3OS/c14-9-10(2-4-11-5-3-10)13-7-1-6-15-8(7)12-9/h1,6,11,13H,2-5H2,(H,12,14)
InChIKeyWNKYVUJILYGSFE-UHFFFAOYSA-N
XLogP1.23
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1,4,9-triazaspiro[5.5]undecane-2,5-dione
CID 66741717
spiro[1,4-dihydroquinoxaline-3,4'-thiane]-2-one
CID 84697857
spiro[4,5-dihydro-1H-pyrrolo[2,3-b]pyrazine-2,1'-cyclopropane]-3-one
CID 82375732
ethane;1,4,9-triazaspiro[5.5]undecane-2,5-dione
CID 142838898
spiro[1,4-dihydroquinoxaline-3,1'-cyclohexane]-2-one
CID 12886753
1,3,8-triazaspiro[4.5]decane-2,4-dione;2,2,2-trifluoroacetic acid
CID 68564691
spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one
CID 82375673
N-(thiophen-2-ylmethyl)spiro[1,4-dihydroquinoxaline-3,4'-piperidine]-2-imine
CID 137104880
2-oxospiro[1,4-dihydrothieno[3,4-b]pyrazine-3,1'-cyclopentane]-7-carboxylic acid
CID 82376398
5,10-diazadispiro[2.2.26.23]decane-4,9-dione
CID 67427050
(3R)-3-ethyl-1,4,9-triazaspiro[5.5]undecane-2,5-dione
CID 176953118
1,4,9-triazaspiro[5.5]undecan-5-one;dihydrochloride
CID 86812140

Frequently Asked Questions

What is the IUPAC name of spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one?
The IUPAC name of spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one (CID 96590760) is spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one.
What is the SMILES notation for spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one?
The canonical SMILES for spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one is O=C1Nc2sccc2NC12CCNCC2.
What is the InChIKey of spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one?
The InChIKey is WNKYVUJILYGSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c14-9-10(2-4-11-5-3-10)13-7-1-6-15-8(7)12-9/h1,6,11,13H,2-5H2,(H,12,14).
What are the key properties of spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one?
spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one has a molecular weight of 223.30 g/mol, XLogP of 1.23, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,4-dihydrothieno[2,3-b]pyrazine-2,4'-piperidine]-3-one is sourced from PubChem (CID 96590760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).