2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide

C13H20N2O2S — CID 114136015

IUPAC2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NCCC1CCCCO1)c1cccs1
InChIInChI=1S/C13H20N2O2S/c14-12(11-5-3-9-18-11)13(16)15-7-6-10-4-1-2-8-17-10/h3,5,9-10,12H,1-2,4,6-8,14H2,(H,15,16)
InChIKeyAQZMOPLILYCZCJ-UHFFFAOYSA-N
MW268.38 g/mol
LogP1.82
Rot. Bonds5

About 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide

2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide (PubChem CID 114136015) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide
PubChem CID114136015
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC Name2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NCCC1CCCCO1)c1cccs1
InChIInChI=1S/C13H20N2O2S/c14-12(11-5-3-9-18-11)13(16)15-7-6-10-4-1-2-8-17-10/h3,5,9-10,12H,1-2,4,6-8,14H2,(H,15,16)
InChIKeyAQZMOPLILYCZCJ-UHFFFAOYSA-N
XLogP1.82
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(oxolan-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 115286809
N-[2-(oxan-2-yl)ethyl]thiophene-2-carboxamide
CID 103993193
2-[2-(oxan-2-yl)ethylamino]-1-thiophen-2-ylethanol
CID 114135927
2-amino-N-(cyclopentylmethyl)-2-thiophen-2-ylacetamide
CID 115286039
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-thiophen-2-ylethanamine
CID 81409134
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 104984102
2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-thiophen-2-ylacetamide
CID 115286057
2-(4-bromophenyl)-2-hydroxy-N-[2-(oxan-2-yl)ethyl]acetamide
CID 75518879
1-(oxan-2-ylmethoxy)-1-thiophen-2-ylpropan-2-amine
CID 55020930
(1S)-N-(oxan-2-ylmethyl)-1-thiophen-2-ylethanamine
CID 81409334
3-amino-N-[2-(oxolan-2-yl)ethyl]-2-phenylpropanamide
CID 62878363
5-[[(2-amino-2-thiophen-2-ylacetyl)amino]methyl]oxolane-2-carboxylic acid
CID 115287506

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide (CID 114136015) is 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide is NC(C(=O)NCCC1CCCCO1)c1cccs1.
What is the InChIKey of 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide?
The InChIKey is AQZMOPLILYCZCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c14-12(11-5-3-9-18-11)13(16)15-7-6-10-4-1-2-8-17-10/h3,5,9-10,12H,1-2,4,6-8,14H2,(H,15,16).
What are the key properties of 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide?
2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide has a molecular weight of 268.38 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(oxan-2-yl)ethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 114136015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).