2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine

C11H16BrNS — CID 65419540

IUPAC2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(Br)s1)C1CC1C
InChIInChI=1S/C11H16BrNS/c1-7-5-9(7)10(13-2)6-8-3-4-11(12)14-8/h3-4,7,9-10,13H,5-6H2,1-2H3
InChIKeyYTCFIAWZOCQKSI-UHFFFAOYSA-N
MW274.23 g/mol
LogP3.30
Rot. Bonds4

About 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine

2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine (PubChem CID 65419540) has the molecular formula C11H16BrNS and a molecular weight of 274.23 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
PubChem CID65419540
Molecular FormulaC11H16BrNS
Molecular Weight274.23 g/mol
Exact Mass273.02
IUPAC Name2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(Br)s1)C1CC1C
InChIInChI=1S/C11H16BrNS/c1-7-5-9(7)10(13-2)6-8-3-4-11(12)14-8/h3-4,7,9-10,13H,5-6H2,1-2H3
InChIKeyYTCFIAWZOCQKSI-UHFFFAOYSA-N
XLogP3.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.23
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-ethylthiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 65422780
2-(5-bromothiophen-2-yl)-N-methyl-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423025
2-(4-bromophenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 61065850
1-(5-bromothiophen-2-yl)-N-methylpropan-2-amine
CID 62602112
N-[2-(5-bromothiophen-2-yl)ethyl]-3,4-dimethylcyclohexan-1-amine
CID 106042746
[2-(5-bromothiophen-2-yl)-1-cyclopropylethyl]hydrazine
CID 105202339
3-(5-bromothiophen-2-yl)-1,1-difluoro-N-methylpropan-2-amine
CID 103516504
[1-(7-bicyclo[4.1.0]heptanyl)-2-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105295777
N-[1-(7-bicyclo[4.1.0]heptanyl)-2-(5-bromothiophen-2-yl)ethyl]propan-1-amine
CID 115840919
[2-(5-bromothiophen-2-yl)-1-(3-ethylcyclopentyl)ethyl]hydrazine
CID 105233392
[2-(5-bromothiophen-2-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105295808
2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 106866952

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The IUPAC name of 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine (CID 65419540) is 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine is CNC(Cc1ccc(Br)s1)C1CC1C.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The InChIKey is YTCFIAWZOCQKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrNS/c1-7-5-9(7)10(13-2)6-8-3-4-11(12)14-8/h3-4,7,9-10,13H,5-6H2,1-2H3.
What are the key properties of 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine has a molecular weight of 274.23 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-N-methyl-1-(2-methylcyclopropyl)ethanamine is sourced from PubChem (CID 65419540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).