N-(4-propan-2-ylthiophen-2-yl)acetamide

C9H13NOS — CID 58913319

IUPACN-(4-propan-2-ylthiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc(C(C)C)cs1
InChIInChI=1S/C9H13NOS/c1-6(2)8-4-9(12-5-8)10-7(3)11/h4-6H,1-3H3,(H,10,11)
InChIKeyXQYOTDHJXFZGKO-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.83
Rot. Bonds2

About N-(4-propan-2-ylthiophen-2-yl)acetamide

N-(4-propan-2-ylthiophen-2-yl)acetamide (PubChem CID 58913319) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is N-(4-propan-2-ylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-propan-2-ylthiophen-2-yl)acetamide
PubChem CID58913319
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC NameN-(4-propan-2-ylthiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc(C(C)C)cs1
InChIInChI=1S/C9H13NOS/c1-6(2)8-4-9(12-5-8)10-7(3)11/h4-6H,1-3H3,(H,10,11)
InChIKeyXQYOTDHJXFZGKO-UHFFFAOYSA-N
XLogP2.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-ylthiophen-2-yl)acetamide?
The IUPAC name of N-(4-propan-2-ylthiophen-2-yl)acetamide (CID 58913319) is N-(4-propan-2-ylthiophen-2-yl)acetamide.
What is the SMILES notation for N-(4-propan-2-ylthiophen-2-yl)acetamide?
The canonical SMILES for N-(4-propan-2-ylthiophen-2-yl)acetamide is CC(=O)Nc1cc(C(C)C)cs1.
What is the InChIKey of N-(4-propan-2-ylthiophen-2-yl)acetamide?
The InChIKey is XQYOTDHJXFZGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-6(2)8-4-9(12-5-8)10-7(3)11/h4-6H,1-3H3,(H,10,11).
What are the key properties of N-(4-propan-2-ylthiophen-2-yl)acetamide?
N-(4-propan-2-ylthiophen-2-yl)acetamide has a molecular weight of 183.28 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-ylthiophen-2-yl)acetamide is sourced from PubChem (CID 58913319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).