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

C15H14N2OS3 — CID 39969261

IUPACN-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCN(Cc1ccsc1)C(=O)Cc1csc(-c2ccsc2)n1
InChIInChI=1S/C15H14N2OS3/c1-17(7-11-2-4-19-8-11)14(18)6-13-10-21-15(16-13)12-3-5-20-9-12/h2-5,8-10H,6-7H2,1H3
InChIKeyYCZOHQRHHZUFPH-UHFFFAOYSA-N
MW334.49 g/mol
LogP4.13
Rot. Bonds5

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

N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 39969261) has the molecular formula C15H14N2OS3 and a molecular weight of 334.49 g/mol. Its IUPAC name is N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
PubChem CID39969261
Molecular FormulaC15H14N2OS3
Molecular Weight334.49 g/mol
Exact Mass334.03
IUPAC NameN-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
SMILESCN(Cc1ccsc1)C(=O)Cc1csc(-c2ccsc2)n1
InChIInChI=1S/C15H14N2OS3/c1-17(7-11-2-4-19-8-11)14(18)6-13-10-21-15(16-13)12-3-5-20-9-12/h2-5,8-10H,6-7H2,1H3
InChIKeyYCZOHQRHHZUFPH-UHFFFAOYSA-N
XLogP4.13
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.49
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide (CID 39969261) is N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide is CN(Cc1ccsc1)C(=O)Cc1csc(-c2ccsc2)n1.
What is the InChIKey of N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is YCZOHQRHHZUFPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS3/c1-17(7-11-2-4-19-8-11)14(18)6-13-10-21-15(16-13)12-3-5-20-9-12/h2-5,8-10H,6-7H2,1H3.
What are the key properties of N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide?
N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 334.49 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(thiophen-3-ylmethyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 39969261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).