3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide

C7H7N5OS — CID 82878352

IUPAC3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide
SMILESNC(=O)c1cn(-c2nccs2)nc1N
InChIInChI=1S/C7H7N5OS/c8-5-4(6(9)13)3-12(11-5)7-10-1-2-14-7/h1-3H,(H2,8,11)(H2,9,13)
InChIKeyIIPFSKZGKRJKFU-UHFFFAOYSA-N
MW209.23 g/mol
LogP0.01
Rot. Bonds2

About 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide

3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide (PubChem CID 82878352) has the molecular formula C7H7N5OS and a molecular weight of 209.23 g/mol. Its IUPAC name is 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide
PubChem CID82878352
Molecular FormulaC7H7N5OS
Molecular Weight209.23 g/mol
Exact Mass209.04
IUPAC Name3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide
SMILESNC(=O)c1cn(-c2nccs2)nc1N
InChIInChI=1S/C7H7N5OS/c8-5-4(6(9)13)3-12(11-5)7-10-1-2-14-7/h1-3H,(H2,8,11)(H2,9,13)
InChIKeyIIPFSKZGKRJKFU-UHFFFAOYSA-N
XLogP0.01
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.23
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1,3-thiazol-2-amine;urea
CID 87216573
2-(3-methyl-1,2,4-triazol-1-yl)-1,3-thiazole
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5-[1-(1,3-thiazol-2-yl)-3-(trifluoromethyl)pyrazol-4-yl]pyridin-2-amine
CID 118016478
1-(1,3-thiazol-2-yl)-2H-pyrazine-3-carboxamide
CID 174854209
1-(1,3-thiazol-2-yl)pyrazole-4-sulfonamide
CID 82881117
N-[5-[3-methyl-1-(1,3-thiazol-2-yl)pyrazol-4-yl]thiophen-2-yl]acetamide
CID 118016504
3-(1,3-thiazol-2-yl)-7H-pyrrolo[2,1-f][1,2,4]triazine-5-carboxamide
CID 67026510
2-(1,3-thiazol-2-yl)benzamide;hydrobromide
CID 143596918
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 18136601
ethyl 5-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxylate
CID 14051868
2-(1,3-thiazol-2-yl)pyrrolo[2,1-f][1,2,4]triazine-5-carboxamide
CID 67026513
4-amino-5-(3-hydroxy-2,6-dimethylphenyl)-2-oxo-1-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 177042736

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The IUPAC name of 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide (CID 82878352) is 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The canonical SMILES for 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide is NC(=O)c1cn(-c2nccs2)nc1N.
What is the InChIKey of 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The InChIKey is IIPFSKZGKRJKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5OS/c8-5-4(6(9)13)3-12(11-5)7-10-1-2-14-7/h1-3H,(H2,8,11)(H2,9,13).
What are the key properties of 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide?
3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide has a molecular weight of 209.23 g/mol, XLogP of 0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(1,3-thiazol-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 82878352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).