2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide

C12H20N2OS — CID 79257384

IUPAC2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide
SMILESCC(NC(=O)CNC(C)(C)C)c1ccsc1
InChIInChI=1S/C12H20N2OS/c1-9(10-5-6-16-8-10)14-11(15)7-13-12(2,3)4/h5-6,8-9,13H,7H2,1-4H3,(H,14,15)
InChIKeyWQHBDIWOHKDYMD-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.31
Rot. Bonds4

About 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide

2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide (PubChem CID 79257384) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide
PubChem CID79257384
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide
SMILESCC(NC(=O)CNC(C)(C)C)c1ccsc1
InChIInChI=1S/C12H20N2OS/c1-9(10-5-6-16-8-10)14-11(15)7-13-12(2,3)4/h5-6,8-9,13H,7H2,1-4H3,(H,14,15)
InChIKeyWQHBDIWOHKDYMD-UHFFFAOYSA-N
XLogP2.31
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(1-thiophen-3-ylethyl)acetamide
CID 62842251
2-[(2-methylpropan-2-yl)oxy]-N-(1-thiophen-3-ylethyl)acetamide
CID 112605150
N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide
CID 62842048
2-methyl-2-(methylamino)-N-(1-thiophen-3-ylethyl)propanamide
CID 62843521
1-hydroxy-3-(1-thiophen-3-ylethyl)urea
CID 23821299
2-(tert-butylamino)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 81408985
2-[2-oxo-2-(1-thiophen-3-ylethylamino)ethoxy]acetic acid
CID 62841517
2-amino-3,3,3-trifluoro-2-methyl-N-(1-thiophen-3-ylethyl)propanamide
CID 79812220
2-methyl-2-(1-thiophen-3-ylethylcarbamoylamino)pentanoic acid
CID 62843561
1-(1-thiophen-3-ylethyl)-3-(2,2,2-trifluoroethyl)urea
CID 116655677
2-(tert-butylamino)-N-[1-(3,4-difluorophenyl)ethyl]acetamide
CID 47839633
2-cyano-2-propyl-N-(1-thiophen-3-ylethyl)pentanamide
CID 62843352

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide (CID 79257384) is 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide is CC(NC(=O)CNC(C)(C)C)c1ccsc1.
What is the InChIKey of 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide?
The InChIKey is WQHBDIWOHKDYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-9(10-5-6-16-8-10)14-11(15)7-13-12(2,3)4/h5-6,8-9,13H,7H2,1-4H3,(H,14,15).
What are the key properties of 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide?
2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide has a molecular weight of 240.37 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide is sourced from PubChem (CID 79257384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).