2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide

C13H20N2OS — CID 107398508

IUPAC2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide
SMILESCCN(CC1CCC1)C(=O)C(N)c1cccs1
InChIInChI=1S/C13H20N2OS/c1-2-15(9-10-5-3-6-10)13(16)12(14)11-7-4-8-17-11/h4,7-8,10,12H,2-3,5-6,9,14H2,1H3
InChIKeyXLHQEUWZCTXQLA-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.40
Rot. Bonds5

About 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide

2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide (PubChem CID 107398508) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide
PubChem CID107398508
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC Name2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide
SMILESCCN(CC1CCC1)C(=O)C(N)c1cccs1
InChIInChI=1S/C13H20N2OS/c1-2-15(9-10-5-3-6-10)13(16)12(14)11-7-4-8-17-11/h4,7-8,10,12H,2-3,5-6,9,14H2,1H3
InChIKeyXLHQEUWZCTXQLA-UHFFFAOYSA-N
XLogP2.40
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(cyclopropylmethyl)-N-propyl-2-thiophen-2-ylacetamide
CID 115286111
2-amino-N-(cyclobutylmethyl)-N-ethyl-2-phenylacetamide
CID 107398345
2-amino-N-ethyl-2-thiophen-2-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 113279196
3-amino-N-(cyclobutylmethyl)-N-ethyl-2-methyl-3-phenylpropanamide
CID 107398357
2-amino-N,N-bis(2-amino-2-oxoethyl)-2-thiophen-2-ylacetamide
CID 113279235
2-amino-N-[2-(dimethylamino)ethyl]-N-propyl-2-thiophen-2-ylacetamide
CID 113279213
2-amino-N-(4-ethylcyclohexyl)-N-methyl-2-thiophen-2-ylacetamide
CID 115286803
2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-2-thiophen-2-ylacetamide
CID 115286756
(2S)-2-amino-N-(cyclobutylmethyl)-N-ethyl-4-phenylbutanamide
CID 107398372
2-amino-N-(cyclopropylmethyl)-N-ethyl-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668472
methyl 2-[(2-amino-2-thiophen-2-ylacetyl)-propylamino]acetate
CID 115286648
2-amino-N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115286709

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide (CID 107398508) is 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide is CCN(CC1CCC1)C(=O)C(N)c1cccs1.
What is the InChIKey of 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide?
The InChIKey is XLHQEUWZCTXQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-2-15(9-10-5-3-6-10)13(16)12(14)11-7-4-8-17-11/h4,7-8,10,12H,2-3,5-6,9,14H2,1H3.
What are the key properties of 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide?
2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide has a molecular weight of 252.38 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclobutylmethyl)-N-ethyl-2-thiophen-2-ylacetamide is sourced from PubChem (CID 107398508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).