N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide

C12H20N2OS — CID 43398125

IUPACN-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide
SMILESCC(C)CNC(=O)CNC(C)c1cccs1
InChIInChI=1S/C12H20N2OS/c1-9(2)7-14-12(15)8-13-10(3)11-5-4-6-16-11/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15)
InChIKeyNFUWJXPMLSMNOO-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.17
Rot. Bonds6

About N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide

N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide (PubChem CID 43398125) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide
PubChem CID43398125
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide
SMILESCC(C)CNC(=O)CNC(C)c1cccs1
InChIInChI=1S/C12H20N2OS/c1-9(2)7-14-12(15)8-13-10(3)11-5-4-6-16-11/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15)
InChIKeyNFUWJXPMLSMNOO-UHFFFAOYSA-N
XLogP2.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[cyclopentyl(thiophen-2-yl)methyl]amino]-N-(2-methylpropyl)acetamide
CID 115900267
2-[[[(1S)-1-thiophen-2-ylethyl]amino]methyl]prop-2-enoic acid
CID 103257806
(2R)-2-[[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]amino]propanoic acid
CID 83193853
N-(2,6-dichlorophenyl)-2-[[(1R)-1-thiophen-2-ylethyl]amino]acetamide
CID 81407882
N-(2-methylbutan-2-yl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]acetamide
CID 81409137
N-cyclohexyl-2-(1-thiophen-2-ylethylamino)acetamide
CID 43398121
N-methyl-N-propan-2-yl-2-[[(1R)-1-thiophen-2-ylethyl]amino]acetamide
CID 81408875
2-bromo-N-[(1R)-1-thiophen-2-ylethyl]prop-2-en-1-amine
CID 81408877
2-(tert-butylamino)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 81408985
2-amino-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115285812
(2R)-1-[[(1R)-1-thiophen-2-ylethyl]amino]propan-2-ol
CID 93082161
(E)-3-methyl-4-(1-thiophen-2-ylethylamino)but-2-enoic acid
CID 103238692

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide?
The IUPAC name of N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide (CID 43398125) is N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide is CC(C)CNC(=O)CNC(C)c1cccs1.
What is the InChIKey of N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide?
The InChIKey is NFUWJXPMLSMNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-9(2)7-14-12(15)8-13-10(3)11-5-4-6-16-11/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15).
What are the key properties of N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide?
N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide has a molecular weight of 240.37 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(1-thiophen-2-ylethylamino)acetamide is sourced from PubChem (CID 43398125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).