N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide

C12H11N3OS — CID 110741726

IUPACN-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide
SMILESO=C(NC1CC1c1cccs1)c1cnccn1
InChIInChI=1S/C12H11N3OS/c16-12(10-7-13-3-4-14-10)15-9-6-8(9)11-2-1-5-17-11/h1-5,7-9H,6H2,(H,15,16)
InChIKeySSSNVHFOZFSXNS-UHFFFAOYSA-N
MW245.31 g/mol
LogP1.82
Rot. Bonds3

About N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide

N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide (PubChem CID 110741726) has the molecular formula C12H11N3OS and a molecular weight of 245.31 g/mol. Its IUPAC name is N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide
PubChem CID110741726
Molecular FormulaC12H11N3OS
Molecular Weight245.31 g/mol
Exact Mass245.06
IUPAC NameN-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide
SMILESO=C(NC1CC1c1cccs1)c1cnccn1
InChIInChI=1S/C12H11N3OS/c16-12(10-7-13-3-4-14-10)15-9-6-8(9)11-2-1-5-17-11/h1-5,7-9H,6H2,(H,15,16)
InChIKeySSSNVHFOZFSXNS-UHFFFAOYSA-N
XLogP1.82
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-thiophen-2-ylcyclopropyl)benzamide
CID 110711228
3-methoxy-N-(2-thiophen-2-ylcyclopropyl)benzamide
CID 110711234
N-[(3R,4R)-3-hydroxy-1-(2-thiophen-2-ylacetyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 70765396
N-(2-thiophen-2-ylcyclopropyl)-1,3-benzodioxole-5-carboxamide
CID 110741734
N-[(1S,2R)-2-(4-fluorophenyl)cyclopropyl]-2-pyrazin-2-yl-1,3-thiazole-4-carboxamide
CID 97077939
N-[(Z)-thiophen-2-ylmethylideneamino]pyrazine-2-carboxamide
CID 5395279
N-[(2R)-2-hydroxy-2-thiophen-2-ylethyl]pyrazine-2-carboxamide
CID 95967203
N-(3-methylpiperidin-4-yl)pyrazine-2-carboxamide
CID 120556268
3-phenyl-N-(2-thiophen-2-ylcyclopropyl)propanamide
CID 110711244
N-[1-(pyrazine-2-carbonyl)piperidin-4-yl]thiophene-2-carboxamide
CID 110821257
2-oxo-N-(2-thiophen-2-ylcyclopropyl)chromene-3-carboxamide
CID 110741738
N-[(3R,4R)-4-hydroxy-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]pyrazine-2-carboxamide
CID 110133362

Frequently Asked Questions

What is the IUPAC name of N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide?
The IUPAC name of N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide (CID 110741726) is N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide is O=C(NC1CC1c1cccs1)c1cnccn1.
What is the InChIKey of N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide?
The InChIKey is SSSNVHFOZFSXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3OS/c16-12(10-7-13-3-4-14-10)15-9-6-8(9)11-2-1-5-17-11/h1-5,7-9H,6H2,(H,15,16).
What are the key properties of N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide?
N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide has a molecular weight of 245.31 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiophen-2-ylcyclopropyl)pyrazine-2-carboxamide is sourced from PubChem (CID 110741726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).