2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide

C8H11BrN2O2S — CID 61329171

IUPAC2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide
SMILESNC(=O)COCC(N)c1ccc(Br)s1
InChIInChI=1S/C8H11BrN2O2S/c9-7-2-1-6(14-7)5(10)3-13-4-8(11)12/h1-2,5H,3-4,10H2,(H2,11,12)
InChIKeyLPOXWJHBXWBOAE-UHFFFAOYSA-N
MW279.16 g/mol
LogP1.01
Rot. Bonds5

About 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide

2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide (PubChem CID 61329171) has the molecular formula C8H11BrN2O2S and a molecular weight of 279.16 g/mol. Its IUPAC name is 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide
PubChem CID61329171
Molecular FormulaC8H11BrN2O2S
Molecular Weight279.16 g/mol
Exact Mass277.97
IUPAC Name2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide
SMILESNC(=O)COCC(N)c1ccc(Br)s1
InChIInChI=1S/C8H11BrN2O2S/c9-7-2-1-6(14-7)5(10)3-13-4-8(11)12/h1-2,5H,3-4,10H2,(H2,11,12)
InChIKeyLPOXWJHBXWBOAE-UHFFFAOYSA-N
XLogP1.01
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.16
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (3S)-3-amino-3-(5-bromothiophen-2-yl)propanoate
CID 29059589
5-amino-5-(5-bromothiophen-2-yl)pentan-2-one
CID 116940683
ethyl 5-amino-5-(5-bromothiophen-2-yl)pentanoate
CID 61104183
methyl 5-amino-5-(5-bromothiophen-2-yl)-3-methylpentanoate
CID 62942196
(1S)-1-(5-bromothiophen-2-yl)butane-1,4-diamine;hydrochloride
CID 171222508
methyl (2R)-2-amino-2-(5-bromothiophen-2-yl)acetate
CID 130055189
ethyl 2-[2-amino-2-(5-methylthiophen-2-yl)ethoxy]acetate
CID 61327208
3-amino-3-[5-(5-bromothiophen-2-yl)thiophen-2-yl]propanoic acid
CID 170872483
1-(5-bromothiophen-2-yl)butane-1,3-diamine
CID 116933230
[3-amino-2-(5-bromothiophen-2-yl)-3-oxopropyl] N-oxocarbamate
CID 141061707
ethyl 2-[2-amino-2-(5-ethylthiophen-2-yl)ethoxy]acetate
CID 61329151
2-[2-amino-2-(4-ethoxyphenyl)ethoxy]acetamide
CID 61327412

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide?
The IUPAC name of 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide (CID 61329171) is 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide.
What is the SMILES notation for 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide?
The canonical SMILES for 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide is NC(=O)COCC(N)c1ccc(Br)s1.
What is the InChIKey of 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide?
The InChIKey is LPOXWJHBXWBOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2O2S/c9-7-2-1-6(14-7)5(10)3-13-4-8(11)12/h1-2,5H,3-4,10H2,(H2,11,12).
What are the key properties of 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide?
2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide has a molecular weight of 279.16 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-amino-2-(5-bromothiophen-2-yl)ethoxy]acetamide is sourced from PubChem (CID 61329171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).