7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide

C12H14N4OS2 — CID 107298629

IUPAC7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
SMILESNc1c(C(=O)NCC2CCSC2)sc2nccnc12
InChIInChI=1S/C12H14N4OS2/c13-8-9-12(15-3-2-14-9)19-10(8)11(17)16-5-7-1-4-18-6-7/h2-3,7H,1,4-6,13H2,(H,16,17)
InChIKeyJORVOLMRHNHJOY-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.76
Rot. Bonds3

About 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide

7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide (PubChem CID 107298629) has the molecular formula C12H14N4OS2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide.

Molecular Properties

Compound Name7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
PubChem CID107298629
Molecular FormulaC12H14N4OS2
Molecular Weight294.40 g/mol
Exact Mass294.06
IUPAC Name7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
SMILESNc1c(C(=O)NCC2CCSC2)sc2nccnc12
InChIInChI=1S/C12H14N4OS2/c13-8-9-12(15-3-2-14-9)19-10(8)11(17)16-5-7-1-4-18-6-7/h2-3,7H,1,4-6,13H2,(H,16,17)
InChIKeyJORVOLMRHNHJOY-UHFFFAOYSA-N
XLogP1.76
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-amino-N-(thian-2-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 80612702
7-amino-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 79361178
3-amino-6-methyl-N-(thiolan-3-ylmethyl)-1-benzothiophene-2-carboxamide
CID 107298626
2-amino-N-(thiolan-3-ylmethyl)pyridine-4-carboxamide
CID 107298151
1-amino-N-(thiolan-3-ylmethyl)isoquinoline-4-carboxamide
CID 107298194
7-amino-N-(5-hydroxypentyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 107323855
7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 106377815
7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 106015917
7-amino-N-(4-hydroxypentyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 106137855
4-amino-2-piperazin-1-yl-N-(thiolan-3-ylmethyl)-1,3-thiazole-5-carboxamide
CID 107299087
3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
CID 107415732
2,3-difluoro-N-(thiolan-3-ylmethyl)pyridine-4-carboxamide
CID 107295633

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide?
The IUPAC name of 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide (CID 107298629) is 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide.
What is the SMILES notation for 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide?
The canonical SMILES for 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide is Nc1c(C(=O)NCC2CCSC2)sc2nccnc12.
What is the InChIKey of 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide?
The InChIKey is JORVOLMRHNHJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS2/c13-8-9-12(15-3-2-14-9)19-10(8)11(17)16-5-7-1-4-18-6-7/h2-3,7H,1,4-6,13H2,(H,16,17).
What are the key properties of 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide?
7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 1.76, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide is sourced from PubChem (CID 107298629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).