4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide

C9H11N5OS — CID 65357658

IUPAC4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)Nc1nccs1
InChIInChI=1S/C9H11N5OS/c1-2-14-7(6(10)5-12-14)8(15)13-9-11-3-4-16-9/h3-5H,2,10H2,1H3,(H,11,13,15)
InChIKeyAHZKNWXXVFEPJZ-UHFFFAOYSA-N
MW237.29 g/mol
LogP1.19
Rot. Bonds3

About 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide

4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide (PubChem CID 65357658) has the molecular formula C9H11N5OS and a molecular weight of 237.29 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
PubChem CID65357658
Molecular FormulaC9H11N5OS
Molecular Weight237.29 g/mol
Exact Mass237.07
IUPAC Name4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
SMILESCCn1ncc(N)c1C(=O)Nc1nccs1
InChIInChI=1S/C9H11N5OS/c1-2-14-7(6(10)5-12-14)8(15)13-9-11-3-4-16-9/h3-5H,2,10H2,1H3,(H,11,13,15)
InChIKeyAHZKNWXXVFEPJZ-UHFFFAOYSA-N
XLogP1.19
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.29
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-1-ethyl-N-pyridin-4-ylpyrazole-5-carboxamide
CID 65357225
4-amino-N-(4-chlorophenyl)-1-ethylpyrazole-5-carboxamide
CID 65357708
4-amino-1-ethyl-N-(1H-pyrazol-4-yl)pyrazole-5-carboxamide
CID 65357048
N-(4-acetylphenyl)-4-amino-1-ethylpyrazole-5-carboxamide
CID 65357059
4-amino-1-ethyl-N-(2-methoxyethyl)pyrazole-5-carboxamide
CID 65356980
1-ethyl-4-nitro-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]pyrazole-5-carboxamide
CID 19476326
3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 61090146
4-amino-N-[4-(cyanomethyl)phenyl]-1-ethylpyrazole-5-carboxamide
CID 65359105
2-amino-N-(1,3-thiazol-2-yl)butanamide
CID 43649283
4-amino-N-(1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 63107015
molecular hydrogen;N-(1,3-thiazol-2-yl)acetamide
CID 143921220
5-ethyl-N-(1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 3354816

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide (CID 65357658) is 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide is CCn1ncc(N)c1C(=O)Nc1nccs1.
What is the InChIKey of 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide?
The InChIKey is AHZKNWXXVFEPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5OS/c1-2-14-7(6(10)5-12-14)8(15)13-9-11-3-4-16-9/h3-5H,2,10H2,1H3,(H,11,13,15).
What are the key properties of 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide?
4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide has a molecular weight of 237.29 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 65357658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).