2-methoxy-2-methyl-N-thiophen-3-ylpropanamide

C9H13NO2S — CID 103678845

IUPAC2-methoxy-2-methyl-N-thiophen-3-ylpropanamide
SMILESCOC(C)(C)C(=O)Nc1ccsc1
InChIInChI=1S/C9H13NO2S/c1-9(2,12-3)8(11)10-7-4-5-13-6-7/h4-6H,1-3H3,(H,10,11)
InChIKeyDSIPHKLOLFWGDM-UHFFFAOYSA-N
MW199.28 g/mol
LogP2.11
Rot. Bonds3

About 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide

2-methoxy-2-methyl-N-thiophen-3-ylpropanamide (PubChem CID 103678845) has the molecular formula C9H13NO2S and a molecular weight of 199.28 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-thiophen-3-ylpropanamide
PubChem CID103678845
Molecular FormulaC9H13NO2S
Molecular Weight199.28 g/mol
Exact Mass199.07
IUPAC Name2-methoxy-2-methyl-N-thiophen-3-ylpropanamide
SMILESCOC(C)(C)C(=O)Nc1ccsc1
InChIInChI=1S/C9H13NO2S/c1-9(2,12-3)8(11)10-7-4-5-13-6-7/h4-6H,1-3H3,(H,10,11)
InChIKeyDSIPHKLOLFWGDM-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The IUPAC name of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide (CID 103678845) is 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide is COC(C)(C)C(=O)Nc1ccsc1.
What is the InChIKey of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
The InChIKey is DSIPHKLOLFWGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S/c1-9(2,12-3)8(11)10-7-4-5-13-6-7/h4-6H,1-3H3,(H,10,11).
What are the key properties of 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide?
2-methoxy-2-methyl-N-thiophen-3-ylpropanamide has a molecular weight of 199.28 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-thiophen-3-ylpropanamide is sourced from PubChem (CID 103678845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).