(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride

C10H17ClN2OS — CID 119291307

IUPAC(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride
SMILESCC(c1cccs1)N(C)C(=O)[C@@H](C)N.Cl
InChIInChI=1S/C10H16N2OS.ClH/c1-7(11)10(13)12(3)8(2)9-5-4-6-14-9;/h4-8H,11H2,1-3H3;1H/t7-,8?;/m1./s1
InChIKeyRGDRXVSIWUFYKP-PGMKYVDRSA-N
MW248.78 g/mol
LogP2.04
Rot. Bonds3

About (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride

(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride (PubChem CID 119291307) has the molecular formula C10H17ClN2OS and a molecular weight of 248.78 g/mol. Its IUPAC name is (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride
PubChem CID119291307
Molecular FormulaC10H17ClN2OS
Molecular Weight248.78 g/mol
Exact Mass248.08
IUPAC Name(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride
SMILESCC(c1cccs1)N(C)C(=O)[C@@H](C)N.Cl
InChIInChI=1S/C10H16N2OS.ClH/c1-7(11)10(13)12(3)8(2)9-5-4-6-14-9;/h4-8H,11H2,1-3H3;1H/t7-,8?;/m1./s1
InChIKeyRGDRXVSIWUFYKP-PGMKYVDRSA-N
XLogP2.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.78
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride (CID 119291307) is (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride is CC(c1cccs1)N(C)C(=O)[C@@H](C)N.Cl.
What is the InChIKey of (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride?
The InChIKey is RGDRXVSIWUFYKP-PGMKYVDRSA-N. The full InChI is InChI=1S/C10H16N2OS.ClH/c1-7(11)10(13)12(3)8(2)9-5-4-6-14-9;/h4-8H,11H2,1-3H3;1H/t7-,8?;/m1./s1.
What are the key properties of (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride?
(2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride has a molecular weight of 248.78 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-methyl-N-(1-thiophen-2-ylethyl)propanamide;hydrochloride is sourced from PubChem (CID 119291307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).