3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide

C10H10N4OS — CID 91466528

IUPAC3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide
SMILESNCc1ncc(-c2cccs2)nc1C(N)=O
InChIInChI=1S/C10H10N4OS/c11-4-6-9(10(12)15)14-7(5-13-6)8-2-1-3-16-8/h1-3,5H,4,11H2,(H2,12,15)
InChIKeyOXVMFQHVQIHCAH-UHFFFAOYSA-N
MW234.28 g/mol
LogP0.76
Rot. Bonds3

About 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide

3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide (PubChem CID 91466528) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide
PubChem CID91466528
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide
SMILESNCc1ncc(-c2cccs2)nc1C(N)=O
InChIInChI=1S/C10H10N4OS/c11-4-6-9(10(12)15)14-7(5-13-6)8-2-1-3-16-8/h1-3,5H,4,11H2,(H2,12,15)
InChIKeyOXVMFQHVQIHCAH-UHFFFAOYSA-N
XLogP0.76
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-methyl-6-thiophen-2-ylpyrazine-2-carboxamide
CID 68650476
3-(aminomethyl)-6-[3-(2-phenylethoxy)phenyl]pyrazine-2-carboxamide
CID 91210304
2-(4-thiophen-2-yl-1,3-thiazol-2-yl)acetamide
CID 9173961
4-thiophen-2-yl-1,2,5-thiadiazole-3-carboxamide
CID 11367830
2-[(5-thiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]acetic acid
CID 6417104
(6-thiophen-2-yl-3-pyridinyl) carbamate
CID 139580211
2-thiophen-2-yl-1,3-thiazole-5-carboxamide
CID 130667272
2-chloro-5-thiophen-2-ylpyrazine
CID 16740536
2,3-dimethyl-6-thiophen-2-ylpyridine-4-carboxamide
CID 154466678
3-thiophen-2-yl-1,2-oxazole-5-carboxamide
CID 776505
methyl 3-amino-6-thiophen-2-ylpyridine-2-carboxylate
CID 167489425
3-methyl-6-thiophen-2-yl-1,2,4-triazine
CID 135139824

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide?
The IUPAC name of 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide (CID 91466528) is 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide is NCc1ncc(-c2cccs2)nc1C(N)=O.
What is the InChIKey of 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide?
The InChIKey is OXVMFQHVQIHCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS/c11-4-6-9(10(12)15)14-7(5-13-6)8-2-1-3-16-8/h1-3,5H,4,11H2,(H2,12,15).
What are the key properties of 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide?
3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-thiophen-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 91466528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).