7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide

C14H14N4OS2 — CID 106015917

IUPAC7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
SMILESCCc1ccc(CNC(=O)c2sc3nccnc3c2N)s1
InChIInChI=1S/C14H14N4OS2/c1-2-8-3-4-9(20-8)7-18-13(19)12-10(15)11-14(21-12)17-6-5-16-11/h3-6H,2,7,15H2,1H3,(H,18,19)
InChIKeySSGSZZUBJFLDFQ-UHFFFAOYSA-N
MW318.43 g/mol
LogP2.83
Rot. Bonds4

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

7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide (PubChem CID 106015917) has the molecular formula C14H14N4OS2 and a molecular weight of 318.43 g/mol. Its IUPAC name is 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide.

Molecular Properties

Compound Name7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
PubChem CID106015917
Molecular FormulaC14H14N4OS2
Molecular Weight318.43 g/mol
Exact Mass318.06
IUPAC Name7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
SMILESCCc1ccc(CNC(=O)c2sc3nccnc3c2N)s1
InChIInChI=1S/C14H14N4OS2/c1-2-8-3-4-9(20-8)7-18-13(19)12-10(15)11-14(21-12)17-6-5-16-11/h3-6H,2,7,15H2,1H3,(H,18,19)
InChIKeySSGSZZUBJFLDFQ-UHFFFAOYSA-N
XLogP2.83
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.43
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 106377815
7-amino-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]thieno[2,3-b]pyrazine-6-carboxamide
CID 79361178
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
2-bromo-N-[(5-ethylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 113255164
N-[(5-ethylthiophen-2-yl)methyl]-3-hydroxypyridine-4-carboxamide
CID 113252821
N-[(5-ethylthiophen-2-yl)methyl]-3-hydrazinylpyridine-4-carboxamide
CID 106012825
7-amino-N-(thian-2-ylmethyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 80612702
(2S)-2-amino-N-[(5-ethylthiophen-2-yl)methyl]butanamide;hydrochloride
CID 119291761
3-amino-2-chloro-N-[(5-ethylthiophen-2-yl)methyl]benzamide
CID 106006505
5-carbamothioyl-N-[(5-ethylthiophen-2-yl)methyl]pyridine-2-carboxamide
CID 106010055

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The IUPAC name of 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide (CID 106015917) is 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide.
What is the SMILES notation for 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The canonical SMILES for 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide is CCc1ccc(CNC(=O)c2sc3nccnc3c2N)s1.
What is the InChIKey of 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
The InChIKey is SSGSZZUBJFLDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS2/c1-2-8-3-4-9(20-8)7-18-13(19)12-10(15)11-14(21-12)17-6-5-16-11/h3-6H,2,7,15H2,1H3,(H,18,19).
What are the key properties of 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide?
7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide has a molecular weight of 318.43 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[(5-ethylthiophen-2-yl)methyl]thieno[2,3-b]pyrazine-6-carboxamide is sourced from PubChem (CID 106015917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).