2,2-dimethyl-N-thiophen-2-ylpropanamide

C9H13NOS — CID 14842268

IUPAC2,2-dimethyl-N-thiophen-2-ylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccs1
InChIInChI=1S/C9H13NOS/c1-9(2,3)8(11)10-7-5-4-6-12-7/h4-6H,1-3H3,(H,10,11)
InChIKeyJXLORYWJCVCLLP-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.73
Rot. Bonds1

About 2,2-dimethyl-N-thiophen-2-ylpropanamide

2,2-dimethyl-N-thiophen-2-ylpropanamide (PubChem CID 14842268) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 2,2-dimethyl-N-thiophen-2-ylpropanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-thiophen-2-ylpropanamide
PubChem CID14842268
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name2,2-dimethyl-N-thiophen-2-ylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccs1
InChIInChI=1S/C9H13NOS/c1-9(2,3)8(11)10-7-5-4-6-12-7/h4-6H,1-3H3,(H,10,11)
InChIKeyJXLORYWJCVCLLP-UHFFFAOYSA-N
XLogP2.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-thiophen-2-ylpropanamide?
The IUPAC name of 2,2-dimethyl-N-thiophen-2-ylpropanamide (CID 14842268) is 2,2-dimethyl-N-thiophen-2-ylpropanamide.
What is the SMILES notation for 2,2-dimethyl-N-thiophen-2-ylpropanamide?
The canonical SMILES for 2,2-dimethyl-N-thiophen-2-ylpropanamide is CC(C)(C)C(=O)Nc1cccs1.
What is the InChIKey of 2,2-dimethyl-N-thiophen-2-ylpropanamide?
The InChIKey is JXLORYWJCVCLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-9(2,3)8(11)10-7-5-4-6-12-7/h4-6H,1-3H3,(H,10,11).
What are the key properties of 2,2-dimethyl-N-thiophen-2-ylpropanamide?
2,2-dimethyl-N-thiophen-2-ylpropanamide has a molecular weight of 183.28 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-thiophen-2-ylpropanamide is sourced from PubChem (CID 14842268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).