2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

C9H11N5OS — CID 43445240

IUPAC2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)Cn2cc(N)cn2)n1
InChIInChI=1S/C9H11N5OS/c1-6-5-16-9(12-6)13-8(15)4-14-3-7(10)2-11-14/h2-3,5H,4,10H2,1H3,(H,12,13,15)
InChIKeyDNMVHTNHAAHAKA-UHFFFAOYSA-N
MW237.29 g/mol
LogP0.87
Rot. Bonds3

About 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide

2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 43445240) has the molecular formula C9H11N5OS and a molecular weight of 237.29 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID43445240
Molecular FormulaC9H11N5OS
Molecular Weight237.29 g/mol
Exact Mass237.07
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)Cn2cc(N)cn2)n1
InChIInChI=1S/C9H11N5OS/c1-6-5-16-9(12-6)13-8(15)4-14-3-7(10)2-11-14/h2-3,5H,4,10H2,1H3,(H,12,13,15)
InChIKeyDNMVHTNHAAHAKA-UHFFFAOYSA-N
XLogP0.87
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 ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 43445240) is 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is Cc1csc(NC(=O)Cn2cc(N)cn2)n1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is DNMVHTNHAAHAKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5OS/c1-6-5-16-9(12-6)13-8(15)4-14-3-7(10)2-11-14/h2-3,5H,4,10H2,1H3,(H,12,13,15).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 237.29 g/mol, XLogP of 0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 43445240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).