3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride

C11H19ClN2OS — CID 119292705

IUPAC3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
SMILESCCN(CCc1cccs1)C(=O)CCN.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-2-13(11(14)5-7-12)8-6-10-4-3-9-15-10;/h3-4,9H,2,5-8,12H2,1H3;1H
InChIKeyVOQWYUNNMVSNPX-UHFFFAOYSA-N
MW262.81 g/mol
LogP1.91
Rot. Bonds6

About 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride

3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride (PubChem CID 119292705) has the molecular formula C11H19ClN2OS and a molecular weight of 262.81 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
PubChem CID119292705
Molecular FormulaC11H19ClN2OS
Molecular Weight262.81 g/mol
Exact Mass262.09
IUPAC Name3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
SMILESCCN(CCc1cccs1)C(=O)CCN.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-2-13(11(14)5-7-12)8-6-10-4-3-9-15-10;/h3-4,9H,2,5-8,12H2,1H3;1H
InChIKeyVOQWYUNNMVSNPX-UHFFFAOYSA-N
XLogP1.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.81
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)ethyl]-N-ethyl-3-thiophen-2-ylpropanamide
CID 70852374
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3-amino-N-ethyl-N-(2-pyridin-4-ylethyl)propanamide
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3-amino-N-propan-2-yl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119289693
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3-[ethyl-[methyl(2-thiophen-2-ylethyl)carbamoyl]amino]propanoic acid
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N-(3-aminopropyl)-N-benzyl-4-thiophen-2-ylbutanamide;hydrochloride
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N-ethyl-4-oxo-4-thiophen-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 78801765
N-[(2-chlorophenyl)methyl]-N-ethyl-3-thiophen-2-ylpropanamide
CID 52572631
3-(ethylamino)-N,N-bis(thiophen-2-ylmethyl)propanamide
CID 62834920
3-amino-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide
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CID 81087639

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride (CID 119292705) is 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride is CCN(CCc1cccs1)C(=O)CCN.Cl.
What is the InChIKey of 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride?
The InChIKey is VOQWYUNNMVSNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS.ClH/c1-2-13(11(14)5-7-12)8-6-10-4-3-9-15-10;/h3-4,9H,2,5-8,12H2,1H3;1H.
What are the key properties of 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride?
3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride has a molecular weight of 262.81 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride is sourced from PubChem (CID 119292705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).