5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

C13H17N5OS — CID 107375321

IUPAC5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)Nc2nc(CC)c(C)s2)cn1
InChIInChI=1S/C13H17N5OS/c1-4-9-8(3)20-13(17-9)18-12(19)10-6-16-11(7-15-10)14-5-2/h6-7H,4-5H2,1-3H3,(H,14,16)(H,17,18,19)
InChIKeyQBQKBSFSOZSVKE-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.49
Rot. Bonds5

About 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide

5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (PubChem CID 107375321) has the molecular formula C13H17N5OS and a molecular weight of 291.38 g/mol. Its IUPAC name is 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
PubChem CID107375321
Molecular FormulaC13H17N5OS
Molecular Weight291.38 g/mol
Exact Mass291.12
IUPAC Name5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)Nc2nc(CC)c(C)s2)cn1
InChIInChI=1S/C13H17N5OS/c1-4-9-8(3)20-13(17-9)18-12(19)10-6-16-11(7-15-10)14-5-2/h6-7H,4-5H2,1-3H3,(H,14,16)(H,17,18,19)
InChIKeyQBQKBSFSOZSVKE-UHFFFAOYSA-N
XLogP2.49
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methyl-1,3-thiazole-4-carboxamide
CID 47444190
4-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-6-methylpyridine-3-carboxamide
CID 81238640
N-(4-cyclopropyl-1,3-thiazol-2-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107375056
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-5-(3-hydroxyprop-1-ynyl)pyridine-2-carboxamide
CID 62960072
2,6-dichloro-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 60786100
4-amino-2-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1,3-thiazole-5-carboxamide
CID 116663783
5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(ethylamino)pyridine-4-carboxamide
CID 114923155
5-(ethylamino)-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 107374377
5-(ethylamino)-N-(2-methyl-4-pyridinyl)pyrazine-2-carboxamide
CID 107376119
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-hydroxy-2-methylpropanamide
CID 104936659
N-(2,2-dimethylbutyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107377291
N-(2-chlorophenyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374242

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide (CID 107375321) is 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is CCNc1cnc(C(=O)Nc2nc(CC)c(C)s2)cn1.
What is the InChIKey of 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
The InChIKey is QBQKBSFSOZSVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5OS/c1-4-9-8(3)20-13(17-9)18-12(19)10-6-16-11(7-15-10)14-5-2/h6-7H,4-5H2,1-3H3,(H,14,16)(H,17,18,19).
What are the key properties of 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide?
5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 107375321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).