N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide

C12H12N4O2S — CID 35523827

IUPACN-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide
SMILESCCc1cc(C(N)=O)c(NC(=O)c2cnccn2)s1
InChIInChI=1S/C12H12N4O2S/c1-2-7-5-8(10(13)17)12(19-7)16-11(18)9-6-14-3-4-15-9/h3-6H,2H2,1H3,(H2,13,17)(H,16,18)
InChIKeyRPYDNGGMCXGZAE-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.45
Rot. Bonds4

About N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide

N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide (PubChem CID 35523827) has the molecular formula C12H12N4O2S and a molecular weight of 276.32 g/mol. Its IUPAC name is N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide
PubChem CID35523827
Molecular FormulaC12H12N4O2S
Molecular Weight276.32 g/mol
Exact Mass276.07
IUPAC NameN-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide
SMILESCCc1cc(C(N)=O)c(NC(=O)c2cnccn2)s1
InChIInChI=1S/C12H12N4O2S/c1-2-7-5-8(10(13)17)12(19-7)16-11(18)9-6-14-3-4-15-9/h3-6H,2H2,1H3,(H2,13,17)(H,16,18)
InChIKeyRPYDNGGMCXGZAE-UHFFFAOYSA-N
XLogP1.45
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,3-dimethylbutanoylamino)-5-ethylthiophene-3-carboxamide
CID 35523946
5-ethyl-2-(pyrimidine-5-carbonylamino)thiophene-3-carboxylic acid
CID 102921506
ethyl 2-[(2-amino-1,3-thiazole-4-carbonyl)amino]-5-ethylthiophene-3-carboxylate
CID 62788622
ethyl 4-carbamoyl-2-methyl-5-(pyrazine-2-carbonylamino)furan-3-carboxylate
CID 108733786
N-[(2S)-1-amino-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 130166243
2-(carbamoylamino)-5-propylthiophene-3-carboxamide
CID 91098871
N-[(6S)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyrazine-2-carboxamide
CID 40579606
methyl 5-ethyl-2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]thiophene-3-carboxylate
CID 17173919
N-(3-carbamoyl-5-propylthiophen-2-yl)-2-methylfuran-3-carboxamide
CID 1245035
N-[2-[[(2S)-1-amino-1-oxobutan-2-yl]amino]-2-oxoethyl]pyrazine-2-carboxamide
CID 70297294
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
3-[[5-ethyl-2-(pyridine-3-carbonylamino)thiophene-3-carbonyl]amino]propanoic acid
CID 82033552

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide?
The IUPAC name of N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide (CID 35523827) is N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide is CCc1cc(C(N)=O)c(NC(=O)c2cnccn2)s1.
What is the InChIKey of N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide?
The InChIKey is RPYDNGGMCXGZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2S/c1-2-7-5-8(10(13)17)12(19-7)16-11(18)9-6-14-3-4-15-9/h3-6H,2H2,1H3,(H2,13,17)(H,16,18).
What are the key properties of N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide?
N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide has a molecular weight of 276.32 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoyl-5-ethylthiophen-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 35523827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).