2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide

C10H12N4OS — CID 121209392

IUPAC2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide
SMILESNCC(=O)Nc1ccnn1Cc1cccs1
InChIInChI=1S/C10H12N4OS/c11-6-10(15)13-9-3-4-12-14(9)7-8-2-1-5-16-8/h1-5H,6-7,11H2,(H,13,15)
InChIKeyWOWHWDMRVISPIE-UHFFFAOYSA-N
MW236.30 g/mol
LogP0.89
Rot. Bonds4

About 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide

2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide (PubChem CID 121209392) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide
PubChem CID121209392
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide
SMILESNCC(=O)Nc1ccnn1Cc1cccs1
InChIInChI=1S/C10H12N4OS/c11-6-10(15)13-9-3-4-12-14(9)7-8-2-1-5-16-8/h1-5H,6-7,11H2,(H,13,15)
InChIKeyWOWHWDMRVISPIE-UHFFFAOYSA-N
XLogP0.89
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide?
The IUPAC name of 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide (CID 121209392) is 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide?
The canonical SMILES for 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide is NCC(=O)Nc1ccnn1Cc1cccs1.
What is the InChIKey of 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide?
The InChIKey is WOWHWDMRVISPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c11-6-10(15)13-9-3-4-12-14(9)7-8-2-1-5-16-8/h1-5H,6-7,11H2,(H,13,15).
What are the key properties of 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide?
2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide has a molecular weight of 236.30 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]acetamide is sourced from PubChem (CID 121209392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).