3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

C10H17ClN2OS — CID 119679292

IUPAC3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCC(C)(CN)C(=O)NCc1cccs1.Cl
InChIInChI=1S/C10H16N2OS.ClH/c1-10(2,7-11)9(13)12-6-8-4-3-5-14-8;/h3-5H,6-7,11H2,1-2H3,(H,12,13);1H
InChIKeyAMDNUWOVKORYNG-UHFFFAOYSA-N
MW248.78 g/mol
LogP1.77
Rot. Bonds4

About 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (PubChem CID 119679292) has the molecular formula C10H17ClN2OS and a molecular weight of 248.78 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
PubChem CID119679292
Molecular FormulaC10H17ClN2OS
Molecular Weight248.78 g/mol
Exact Mass248.08
IUPAC Name3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCC(C)(CN)C(=O)NCc1cccs1.Cl
InChIInChI=1S/C10H16N2OS.ClH/c1-10(2,7-11)9(13)12-6-8-4-3-5-14-8;/h3-5H,6-7,11H2,1-2H3,(H,12,13);1H
InChIKeyAMDNUWOVKORYNG-UHFFFAOYSA-N
XLogP1.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.78
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-(methylamino)-N-(thiophen-2-ylmethyl)propanamide
CID 62835443
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CID 119727869
3-amino-2,2-dimethyl-N-[(5-methylthiophen-2-yl)methyl]propanamide
CID 81489224
4-amino-2,2-dimethyl-N-(2-thiophen-2-ylethyl)butanamide
CID 115157089
3,3-dimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 1246126
N,N'-bis(thiophen-2-ylmethyl)oxamide
CID 6421749
3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119681753
2,2-dimethyl-3-(2,3,5,6-tetrafluorophenyl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide
CID 134106708
3-amino-N-[[3-(hydroxymethyl)phenyl]methyl]-2,2-dimethylpropanamide;hydrochloride
CID 119775484
3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide
CID 106895482
5-tert-butyl-1-N,3-N-bis(thiophen-2-ylmethyl)benzene-1,3-dicarboxamide
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CID 1245174

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (CID 119679292) is 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is CC(C)(CN)C(=O)NCc1cccs1.Cl.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The InChIKey is AMDNUWOVKORYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS.ClH/c1-10(2,7-11)9(13)12-6-8-4-3-5-14-8;/h3-5H,6-7,11H2,1-2H3,(H,12,13);1H.
What are the key properties of 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride has a molecular weight of 248.78 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is sourced from PubChem (CID 119679292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).