2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide

C10H11N3OS2 — CID 2701269

IUPAC2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILES[H]/N=c1\sccn1CC(=O)NCc1cccs1
InChIInChI=1S/C10H11N3OS2/c11-10-13(3-5-16-10)7-9(14)12-6-8-2-1-4-15-8/h1-5,11H,6-7H2,(H,12,14)/b11-10-
InChIKeyDIWKSGCMYKPGTF-KHPPLWFESA-N
MW253.35 g/mol
LogP1.41
Rot. Bonds4

About 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide

2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 2701269) has the molecular formula C10H11N3OS2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID2701269
Molecular FormulaC10H11N3OS2
Molecular Weight253.35 g/mol
Exact Mass253.03
IUPAC Name2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILES[H]/N=c1\sccn1CC(=O)NCc1cccs1
InChIInChI=1S/C10H11N3OS2/c11-10-13(3-5-16-10)7-9(14)12-6-8-2-1-4-15-8/h1-5,11H,6-7H2,(H,12,14)/b11-10-
InChIKeyDIWKSGCMYKPGTF-KHPPLWFESA-N
XLogP1.41
TPSA57.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide (CID 2701269) is 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide is [H]/N=c1\sccn1CC(=O)NCc1cccs1.
What is the InChIKey of 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is DIWKSGCMYKPGTF-KHPPLWFESA-N. The full InChI is InChI=1S/C10H11N3OS2/c11-10-13(3-5-16-10)7-9(14)12-6-8-2-1-4-15-8/h1-5,11H,6-7H2,(H,12,14)/b11-10-.
What are the key properties of 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 253.35 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-imino-1,3-thiazol-3-yl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 2701269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).