2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride

C8H12Cl2N2OS — CID 119296190

IUPAC2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride
SMILESCl.NCC(=O)NCCc1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS.ClH/c9-7-2-1-6(13-7)3-4-11-8(12)5-10;/h1-2H,3-5,10H2,(H,11,12);1H
InChIKeyUQCFMBVHBOCEPI-UHFFFAOYSA-N
MW255.17 g/mol
LogP1.44
Rot. Bonds4

About 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride

2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride (PubChem CID 119296190) has the molecular formula C8H12Cl2N2OS and a molecular weight of 255.17 g/mol. Its IUPAC name is 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride
PubChem CID119296190
Molecular FormulaC8H12Cl2N2OS
Molecular Weight255.17 g/mol
Exact Mass254.00
IUPAC Name2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride
SMILESCl.NCC(=O)NCCc1ccc(Cl)s1
InChIInChI=1S/C8H11ClN2OS.ClH/c9-7-2-1-6(13-7)3-4-11-8(12)5-10;/h1-2H,3-5,10H2,(H,11,12);1H
InChIKeyUQCFMBVHBOCEPI-UHFFFAOYSA-N
XLogP1.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.17
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(5-chlorothiophen-2-yl)ethylamino]-3-oxopropanoic acid
CID 104889314
2-(5-chlorothiophen-2-yl)ethylcarbamic acid
CID 115171101
N-[2-(5-chlorothiophen-2-yl)ethyl]-2-(methylamino)acetamide;hydrochloride
CID 119735855
4-[2-(5-chlorothiophen-2-yl)ethylamino]-4-oxobutanoic acid
CID 103925944
(3E)-3-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]-3-hydroxyiminopropanamide
CID 106041277
2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]-3-hydroxypropanamide
CID 115180056
(2S)-2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]propanamide
CID 103630177
3-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]-3-phenylpropanamide;hydrochloride
CID 119950206
3-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]-2,2,3-trimethylbutanamide
CID 114140578
3-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]-2-phenylpropanamide;hydrochloride
CID 119735845
4-(2-aminoethyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]-5,5-dimethylhexanamide
CID 106047856
1-(aminomethyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]cycloheptane-1-carboxamide
CID 106047919

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride (CID 119296190) is 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride is Cl.NCC(=O)NCCc1ccc(Cl)s1.
What is the InChIKey of 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride?
The InChIKey is UQCFMBVHBOCEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2OS.ClH/c9-7-2-1-6(13-7)3-4-11-8(12)5-10;/h1-2H,3-5,10H2,(H,11,12);1H.
What are the key properties of 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride?
2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride has a molecular weight of 255.17 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(5-chlorothiophen-2-yl)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119296190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).