N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide

C11H17NOS — CID 977581

IUPACN-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide
SMILESCCC(C)(C)NC(=O)Cc1cccs1
InChIInChI=1S/C11H17NOS/c1-4-11(2,3)12-10(13)8-9-6-5-7-14-9/h5-7H,4,8H2,1-3H3,(H,12,13)
InChIKeyIQECENZEQWRRST-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.60
Rot. Bonds4

About N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide

N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide (PubChem CID 977581) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide
PubChem CID977581
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC NameN-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide
SMILESCCC(C)(C)NC(=O)Cc1cccs1
InChIInChI=1S/C11H17NOS/c1-4-11(2,3)12-10(13)8-9-6-5-7-14-9/h5-7H,4,8H2,1-3H3,(H,12,13)
InChIKeyIQECENZEQWRRST-UHFFFAOYSA-N
XLogP2.60
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide (CID 977581) is N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide is CCC(C)(C)NC(=O)Cc1cccs1.
What is the InChIKey of N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide?
The InChIKey is IQECENZEQWRRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-4-11(2,3)12-10(13)8-9-6-5-7-14-9/h5-7H,4,8H2,1-3H3,(H,12,13).
What are the key properties of N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide?
N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide has a molecular weight of 211.33 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 977581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).