N-propan-2-yl-2-thiophen-3-ylacetamide

C9H13NOS — CID 23548834

IUPACN-propan-2-yl-2-thiophen-3-ylacetamide
SMILESCC(C)NC(=O)Cc1ccsc1
InChIInChI=1S/C9H13NOS/c1-7(2)10-9(11)5-8-3-4-12-6-8/h3-4,6-7H,5H2,1-2H3,(H,10,11)
InChIKeyOJVWLWWTQFXEMX-UHFFFAOYSA-N
MW183.28 g/mol
LogP1.82
Rot. Bonds3

About N-propan-2-yl-2-thiophen-3-ylacetamide

N-propan-2-yl-2-thiophen-3-ylacetamide (PubChem CID 23548834) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is N-propan-2-yl-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-thiophen-3-ylacetamide
PubChem CID23548834
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC NameN-propan-2-yl-2-thiophen-3-ylacetamide
SMILESCC(C)NC(=O)Cc1ccsc1
InChIInChI=1S/C9H13NOS/c1-7(2)10-9(11)5-8-3-4-12-6-8/h3-4,6-7H,5H2,1-2H3,(H,10,11)
InChIKeyOJVWLWWTQFXEMX-UHFFFAOYSA-N
XLogP1.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-thiophen-3-ylacetamide?
The IUPAC name of N-propan-2-yl-2-thiophen-3-ylacetamide (CID 23548834) is N-propan-2-yl-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-propan-2-yl-2-thiophen-3-ylacetamide?
The canonical SMILES for N-propan-2-yl-2-thiophen-3-ylacetamide is CC(C)NC(=O)Cc1ccsc1.
What is the InChIKey of N-propan-2-yl-2-thiophen-3-ylacetamide?
The InChIKey is OJVWLWWTQFXEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-7(2)10-9(11)5-8-3-4-12-6-8/h3-4,6-7H,5H2,1-2H3,(H,10,11).
What are the key properties of N-propan-2-yl-2-thiophen-3-ylacetamide?
N-propan-2-yl-2-thiophen-3-ylacetamide has a molecular weight of 183.28 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-thiophen-3-ylacetamide is sourced from PubChem (CID 23548834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).