N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide

C14H24N2OS — CID 122135166

IUPACN-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide
SMILESCC(C)(C)CNC(=O)C(C)(C)NCc1cccs1
InChIInChI=1S/C14H24N2OS/c1-13(2,3)10-15-12(17)14(4,5)16-9-11-7-6-8-18-11/h6-8,16H,9-10H2,1-5H3,(H,15,17)
InChIKeyZYGKTRWFXGPELA-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.78
Rot. Bonds5

About N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide

N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide (PubChem CID 122135166) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide
PubChem CID122135166
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide
SMILESCC(C)(C)CNC(=O)C(C)(C)NCc1cccs1
InChIInChI=1S/C14H24N2OS/c1-13(2,3)10-15-12(17)14(4,5)16-9-11-7-6-8-18-11/h6-8,16H,9-10H2,1-5H3,(H,15,17)
InChIKeyZYGKTRWFXGPELA-UHFFFAOYSA-N
XLogP2.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide?
The IUPAC name of N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide (CID 122135166) is N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide is CC(C)(C)CNC(=O)C(C)(C)NCc1cccs1.
What is the InChIKey of N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide?
The InChIKey is ZYGKTRWFXGPELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-13(2,3)10-15-12(17)14(4,5)16-9-11-7-6-8-18-11/h6-8,16H,9-10H2,1-5H3,(H,15,17).
What are the key properties of N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide?
N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide has a molecular weight of 268.43 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-2-methyl-2-(thiophen-2-ylmethylamino)propanamide is sourced from PubChem (CID 122135166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).