N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide

C15H23NO2S — CID 112686851

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C15H23NO2S/c1-11(2)18-10-14(17)16-15(12-6-3-4-7-12)13-8-5-9-19-13/h5,8-9,11-12,15H,3-4,6-7,10H2,1-2H3,(H,16,17)
InChIKeyBUDCWOZBVJWEEU-UHFFFAOYSA-N
MW281.42 g/mol
LogP3.52
Rot. Bonds6

About N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide

N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide (PubChem CID 112686851) 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-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide
PubChem CID112686851
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide
SMILESCC(C)OCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C15H23NO2S/c1-11(2)18-10-14(17)16-15(12-6-3-4-7-12)13-8-5-9-19-13/h5,8-9,11-12,15H,3-4,6-7,10H2,1-2H3,(H,16,17)
InChIKeyBUDCWOZBVJWEEU-UHFFFAOYSA-N
XLogP3.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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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Related Compounds

N-[phenyl(thiophen-2-yl)methyl]oxolane-2-carboxamide
CID 45845812
N-(3-methyl-1-thiophen-2-ylbutyl)propanamide
CID 51089364
2-[2-[(3-Methyl-1-thiophen-2-ylbutyl)amino]-2-oxoethyl]sulfanylacetamide
CID 56822561
N-{[(3S,4R)-3-(dimethylamino)-1-(2-thienylmethyl)hexahydro-4-pyridinyl]methyl}-2-methoxyacetamide
CID 91920972
2-(2-methylpropoxy)-N-(1-thiophen-2-ylethyl)propanamide
CID 45818566
N-(1-thiophen-2-ylethyl)-2-(2,2,2-trifluoroethoxy)propanamide
CID 45887448
N-(2-phenyl-1-thiophen-2-ylethyl)oxolane-2-carboxamide
CID 56791666
N-(2-phenyl-1-thiophen-2-ylethyl)-1,4-dioxane-2-carboxamide
CID 72011690
(2S)-2-ethoxy-N-(thiophen-2-ylmethyl)propanamide
CID 93615811
N-[(1S)-2-ethyl-1-thiophen-2-ylbutyl]acetamide
CID 94635896
[2-[[(S)-(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl] 2-methylpropanoate
CID 8226548
[2-[[(R)-(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl] 2-methylpropanoate
CID 8226549

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide (CID 112686851) is N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide is CC(C)OCC(=O)NC(c1cccs1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide?
The InChIKey is BUDCWOZBVJWEEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-11(2)18-10-14(17)16-15(12-6-3-4-7-12)13-8-5-9-19-13/h5,8-9,11-12,15H,3-4,6-7,10H2,1-2H3,(H,16,17).
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide?
N-[cyclopentyl(thiophen-2-yl)methyl]-2-propan-2-yloxyacetamide has a molecular weight of 281.42 g/mol, XLogP of 3.52, 6 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-propan-2-yloxyacetamide is sourced from PubChem (CID 112686851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).