2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide

C16H20N2O2S — CID 115286511

IUPAC2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide
SMILESCOCCN(Cc1ccccc1)C(=O)C(N)c1cccs1
InChIInChI=1S/C16H20N2O2S/c1-20-10-9-18(12-13-6-3-2-4-7-13)16(19)15(17)14-8-5-11-21-14/h2-8,11,15H,9-10,12,17H2,1H3
InChIKeyKUGPTEXAGZPQDS-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.42
Rot. Bonds7

About 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide

2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide (PubChem CID 115286511) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide
PubChem CID115286511
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC Name2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide
SMILESCOCCN(Cc1ccccc1)C(=O)C(N)c1cccs1
InChIInChI=1S/C16H20N2O2S/c1-20-10-9-18(12-13-6-3-2-4-7-13)16(19)15(17)14-8-5-11-21-14/h2-8,11,15H,9-10,12,17H2,1H3
InChIKeyKUGPTEXAGZPQDS-UHFFFAOYSA-N
XLogP2.42
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-benzyl-N-propyl-2-thiophen-2-ylacetamide
CID 115286106
N-benzyl-2,2-difluoro-N-(2-methoxyethyl)acetamide
CID 103515233
(2S)-2-amino-N-benzyl-N-(2-methoxyethyl)pentanamide
CID 93367288
(2S)-2-amino-N-benzyl-N-[2-(2-methoxyethoxy)ethyl]propanamide;hydrochloride
CID 119341269
N-benzyl-N-(2-methoxyethyl)-4-thiophen-2-ylbutanamide
CID 78781430
N-benzyl-N-(2-methoxyethyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 78781446
2-[benzyl(2-methoxyethyl)amino]-2-oxoacetic acid
CID 127020353
2-amino-N,N-bis(2-amino-2-oxoethyl)-2-thiophen-2-ylacetamide
CID 113279235
methyl 2-[(2-amino-2-thiophen-2-ylacetyl)-propylamino]acetate
CID 115286648
2-amino-N-(2-methoxyethyl)-4-methyl-N-(thiophen-2-ylmethyl)pentanamide
CID 54869709
(2R)-2-amino-N-ethyl-N-(2-methoxyethyl)-2-phenylacetamide
CID 54949185
(2S)-2-amino-N-benzyl-N-(2-hydroxy-2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 119342483

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide (CID 115286511) is 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide is COCCN(Cc1ccccc1)C(=O)C(N)c1cccs1.
What is the InChIKey of 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide?
The InChIKey is KUGPTEXAGZPQDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-20-10-9-18(12-13-6-3-2-4-7-13)16(19)15(17)14-8-5-11-21-14/h2-8,11,15H,9-10,12,17H2,1H3.
What are the key properties of 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide?
2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide has a molecular weight of 304.42 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 115286511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).