N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

C16H25NO2S — CID 115950033

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C16H25NO2S/c1-16(2,3)19-11-14(18)17-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15H,4-5,7-8,11H2,1-3H3,(H,17,18)
InChIKeyMPYZAOZZHZJYQG-UHFFFAOYSA-N
MW295.45 g/mol
LogP3.91
Rot. Bonds5

About N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide

N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 115950033) has the molecular formula C16H25NO2S and a molecular weight of 295.45 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID115950033
Molecular FormulaC16H25NO2S
Molecular Weight295.45 g/mol
Exact Mass295.16
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C16H25NO2S/c1-16(2,3)19-11-14(18)17-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15H,4-5,7-8,11H2,1-3H3,(H,17,18)
InChIKeyMPYZAOZZHZJYQG-UHFFFAOYSA-N
XLogP3.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 53.91
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-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 115950033) is N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)(C)OCC(=O)NC(c1cccs1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is MPYZAOZZHZJYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2S/c1-16(2,3)19-11-14(18)17-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15H,4-5,7-8,11H2,1-3H3,(H,17,18).
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-[cyclopentyl(thiophen-2-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 295.45 g/mol, XLogP of 3.91, 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-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 115950033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).