N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide

C12H20N2OS — CID 62842048

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

About N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide

N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide (PubChem CID 62842048) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide
PubChem CID62842048
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide
SMILESCC(NCC(=O)NC(C)(C)C)c1ccsc1
InChIInChI=1S/C12H20N2OS/c1-9(10-5-6-16-8-10)13-7-11(15)14-12(2,3)4/h5-6,8-9,13H,7H2,1-4H3,(H,14,15)
InChIKeyKCSZAHGRXFTZOQ-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

Analyze N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide
CID 79257384
N-tert-butyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 28564730
2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-N-tert-butylacetamide
CID 81359238
N-tert-butyl-2-[1-(3-hydroxyphenyl)ethylamino]acetamide
CID 113293150
N-tert-butyl-2-(1-thiophen-3-ylethylamino)propanamide
CID 62841877
2,2-dimethyl-N-(1-thiophen-3-ylethyl)propan-1-amine
CID 62090002
N-tert-butyl-2-[1-(5-chlorothiophen-3-yl)ethylamino]acetamide
CID 102976365
2-methylidene-N-(1-thiophen-3-ylethyl)butan-1-amine
CID 66046894
N-tert-butyl-2-[1-[4-(2-methylpropyl)phenyl]ethylamino]acetamide
CID 78913238
2-[(2-methylpropan-2-yl)oxy]-N-(1-thiophen-3-ylethyl)acetamide
CID 112605150
N-tert-butyl-2-[1-(4-propylphenyl)ethylamino]acetamide
CID 81298338
2-chloro-N-(1-thiophen-3-ylethyl)acetamide
CID 62842251

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide (CID 62842048) is N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide is CC(NCC(=O)NC(C)(C)C)c1ccsc1.
What is the InChIKey of N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide?
The InChIKey is KCSZAHGRXFTZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-9(10-5-6-16-8-10)13-7-11(15)14-12(2,3)4/h5-6,8-9,13H,7H2,1-4H3,(H,14,15).
What are the key properties of N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide?
N-tert-butyl-2-(1-thiophen-3-ylethylamino)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 N-tert-butyl-2-(1-thiophen-3-ylethylamino)acetamide is sourced from PubChem (CID 62842048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).