7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide

C13H13N5O2S — CID 106377815

IUPAC7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
SMILESCc1nc(CNC(=O)c2sc3nccnc3c2N)oc1C
InChIInChI=1S/C13H13N5O2S/c1-6-7(2)20-8(18-6)5-17-12(19)11-9(14)10-13(21-11)16-4-3-15-10/h3-4H,5,14H2,1-2H3,(H,17,19)
InChIKeyRHUVADFYLGIBHK-UHFFFAOYSA-N
MW303.35 g/mol
LogP1.81
Rot. Bonds3

About 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide

7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide (PubChem CID 106377815) has the molecular formula C13H13N5O2S and a molecular weight of 303.35 g/mol. Its IUPAC name is 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide.

Molecular Properties

Compound Name7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
PubChem CID106377815
Molecular FormulaC13H13N5O2S
Molecular Weight303.35 g/mol
Exact Mass303.08
IUPAC Name7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
SMILESCc1nc(CNC(=O)c2sc3nccnc3c2N)oc1C
InChIInChI=1S/C13H13N5O2S/c1-6-7(2)20-8(18-6)5-17-12(19)11-9(14)10-13(21-11)16-4-3-15-10/h3-4H,5,14H2,1-2H3,(H,17,19)
InChIKeyRHUVADFYLGIBHK-UHFFFAOYSA-N
XLogP1.81
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.35
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide with MolForge

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Related Compounds

7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 106015917
7-amino-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 79361178
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-methylthiophene-2-carboxamide
CID 47344953
7-amino-N-(5-hydroxypentyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 107323855
7-amino-N-(4-hydroxypentyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 106137855
7-amino-N-(thiolan-3-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 107298629
4-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,5-difluorobenzamide
CID 106377408
7-amino-N-(thian-2-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 80612702
2-amino-5-chloro-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
CID 106377371
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thiophene-3-carboxamide
CID 47345026
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-hydroxypyridine-2-carboxamide
CID 113229810
4-chloro-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-oxo-1,2-thiazole-5-carboxamide
CID 166263123

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The IUPAC name of 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide (CID 106377815) is 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide.
What is the SMILES notation for 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The canonical SMILES for 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide is Cc1nc(CNC(=O)c2sc3nccnc3c2N)oc1C.
What is the InChIKey of 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The InChIKey is RHUVADFYLGIBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O2S/c1-6-7(2)20-8(18-6)5-17-12(19)11-9(14)10-13(21-11)16-4-3-15-10/h3-4H,5,14H2,1-2H3,(H,17,19).
What are the key properties of 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide has a molecular weight of 303.35 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide is sourced from PubChem (CID 106377815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).