2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride

C12H21ClN2OS — CID 119722730

IUPAC2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NC(C)Cc1cccs1.Cl
InChIInChI=1S/C12H20N2OS.ClH/c1-9(8-13-3)12(15)14-10(2)7-11-5-4-6-16-11;/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15);1H
InChIKeyDTSRRKBOGROEAU-UHFFFAOYSA-N
MW276.83 g/mol
LogP2.07
Rot. Bonds6

About 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride

2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride (PubChem CID 119722730) has the molecular formula C12H21ClN2OS and a molecular weight of 276.83 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
PubChem CID119722730
Molecular FormulaC12H21ClN2OS
Molecular Weight276.83 g/mol
Exact Mass276.11
IUPAC Name2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NC(C)Cc1cccs1.Cl
InChIInChI=1S/C12H20N2OS.ClH/c1-9(8-13-3)12(15)14-10(2)7-11-5-4-6-16-11;/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15);1H
InChIKeyDTSRRKBOGROEAU-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.83
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-3-methyl-N-(1-thiophen-2-ylpropan-2-yl)pentanamide
CID 61174235
3-amino-2-phenyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119722711
3-amino-2-methyl-3-phenyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119722719
1-(thiophen-2-ylmethyl)-3-(1-thiophen-2-ylpropan-2-yl)urea
CID 45497246
2-(propan-2-ylamino)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
CID 60842186
N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide
CID 51897806
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
3-bromo-N-(1-thiophen-2-ylpropan-2-yl)propanamide
CID 82110960
N-propan-2-yl-2-(1-thiophen-2-ylpropan-2-ylamino)propanamide
CID 63291724
(2S)-3-hydroxy-2-(1-thiophen-2-ylpropan-2-ylcarbamoylamino)propanoic acid
CID 63292410
2-(1-thiophen-2-ylpropan-2-ylcarbamoylamino)butanoic acid
CID 55171571
N,2-dimethyl-3-(methylamino)-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 119807079

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride?
The IUPAC name of 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride (CID 119722730) is 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride?
The canonical SMILES for 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride is CNCC(C)C(=O)NC(C)Cc1cccs1.Cl.
What is the InChIKey of 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride?
The InChIKey is DTSRRKBOGROEAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS.ClH/c1-9(8-13-3)12(15)14-10(2)7-11-5-4-6-16-11;/h4-6,9-10,13H,7-8H2,1-3H3,(H,14,15);1H.
What are the key properties of 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride?
2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride has a molecular weight of 276.83 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-(1-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 119722730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).