N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide

C9H13NO2S — CID 39086744

IUPACN-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide
SMILESC[C@H](CO)NC(=O)Cc1cccs1
InChIInChI=1S/C9H13NO2S/c1-7(6-11)10-9(12)5-8-3-2-4-13-8/h2-4,7,11H,5-6H2,1H3,(H,10,12)/t7-/m1/s1
InChIKeyQVMAPUZMPLGHDI-SSDOTTSWSA-N
MW199.28 g/mol
LogP0.79
Rot. Bonds4

About N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide

N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide (PubChem CID 39086744) has the molecular formula C9H13NO2S and a molecular weight of 199.28 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide
PubChem CID39086744
Molecular FormulaC9H13NO2S
Molecular Weight199.28 g/mol
Exact Mass199.07
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide
SMILESC[C@H](CO)NC(=O)Cc1cccs1
InChIInChI=1S/C9H13NO2S/c1-7(6-11)10-9(12)5-8-3-2-4-13-8/h2-4,7,11H,5-6H2,1H3,(H,10,12)/t7-/m1/s1
InChIKeyQVMAPUZMPLGHDI-SSDOTTSWSA-N
XLogP0.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-chloropropan-2-yl)-2-thiophen-2-ylacetamide
CID 114299702
N-(1-aminoethyl)-2-thiophen-2-ylacetamide
CID 173143442
N-(4-amino-4-sulfanylidenebutan-2-yl)-2-thiophen-2-ylacetamide
CID 62092047
N-(1-amino-1-sulfanylidenepropan-2-yl)-2-thiophen-2-ylacetamide
CID 61120272
N-[1-(4-methylphenoxy)propan-2-yl]-2-thiophen-2-ylacetamide
CID 47450824
(2R)-N-ethyl-2-[(2-thiophen-2-ylacetyl)amino]propanamide
CID 8750175
N-[(2S)-1-(3-chlorophenyl)propan-2-yl]-2-thiophen-2-ylacetamide
CID 51947501
N-(1-hydroxypropan-2-yl)-2-thiophen-2-ylsulfanylacetamide
CID 43427808
N-[1-(5-methylfuran-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 47007711
N-[1-(2-methylphenyl)ethyl]-2-thiophen-2-ylacetamide
CID 47004762
N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 94182945
N-[1-(4-bromophenyl)ethyl]-2-thiophen-2-ylacetamide
CID 42999115

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide (CID 39086744) is N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide is C[C@H](CO)NC(=O)Cc1cccs1.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide?
The InChIKey is QVMAPUZMPLGHDI-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H13NO2S/c1-7(6-11)10-9(12)5-8-3-2-4-13-8/h2-4,7,11H,5-6H2,1H3,(H,10,12)/t7-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide?
N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide has a molecular weight of 199.28 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 39086744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).