N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide

C15H23NO2S — CID 103028923

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C15H23NO2S/c1-15(2,18-3)14(17)16-13(11-7-4-5-8-11)12-9-6-10-19-12/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,16,17)
InChIKeyWNDXCFUVCWIVIV-UHFFFAOYSA-N
MW281.42 g/mol
LogP3.52
Rot. Bonds5

About N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide

N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide (PubChem CID 103028923) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide
PubChem CID103028923
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C15H23NO2S/c1-15(2,18-3)14(17)16-13(11-7-4-5-8-11)12-9-6-10-19-12/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,16,17)
InChIKeyWNDXCFUVCWIVIV-UHFFFAOYSA-N
XLogP3.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide (CID 103028923) is N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide is COC(C)(C)C(=O)NC(c1cccs1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide?
The InChIKey is WNDXCFUVCWIVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-15(2,18-3)14(17)16-13(11-7-4-5-8-11)12-9-6-10-19-12/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,16,17).
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide?
N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide has a molecular weight of 281.42 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxy-2-methylpropanamide is sourced from PubChem (CID 103028923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).