2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine

C11H15N3S — CID 63773737

IUPAC2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine
SMILESNCCc1nccn1CCc1cccs1
InChIInChI=1S/C11H15N3S/c12-5-3-11-13-6-8-14(11)7-4-10-2-1-9-15-10/h1-2,6,8-9H,3-5,7,12H2
InChIKeyCHPLBJGZKKLILR-UHFFFAOYSA-N
MW221.33 g/mol
LogP1.69
Rot. Bonds5

About 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine

2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine (PubChem CID 63773737) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine
PubChem CID63773737
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine
SMILESNCCc1nccn1CCc1cccs1
InChIInChI=1S/C11H15N3S/c12-5-3-11-13-6-8-14(11)7-4-10-2-1-9-15-10/h1-2,6,8-9H,3-5,7,12H2
InChIKeyCHPLBJGZKKLILR-UHFFFAOYSA-N
XLogP1.69
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]butan-2-amine
CID 55235170
2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]sulfanylethanamine
CID 94691066
2-methylsulfonyl-1-(2-thiophen-2-ylethyl)imidazole
CID 82132226
2-[1-(2-fluoroethyl)imidazol-2-yl]ethanamine
CID 80694657
2-[1-(2-methoxyethyl)imidazol-2-yl]ethanamine
CID 62410004
2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]sulfanylethanol
CID 94691207
2-[[1-(2-phenylethyl)imidazol-2-yl]methyl]-1-(2-thiophen-2-ylethyl)guanidine
CID 111911568
1-(1-methylimidazol-2-yl)-5-thiophen-2-ylpentan-2-one
CID 105116298
molecular hydrogen;2-thiophen-2-ylethanamine
CID 142393573
2-[[2-(thiophen-2-ylmethyl)imidazol-1-yl]methyl]aniline
CID 82557902
1-[2-(1-benzylimidazol-2-yl)ethyl]-2-(2-thiophen-2-ylethyl)guanidine
CID 111042126
N-(3-methoxypropyl)-1-(2-thiophen-2-ylethyl)imidazol-2-amine
CID 106559088

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine?
The IUPAC name of 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine (CID 63773737) is 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine is NCCc1nccn1CCc1cccs1.
What is the InChIKey of 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine?
The InChIKey is CHPLBJGZKKLILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c12-5-3-11-13-6-8-14(11)7-4-10-2-1-9-15-10/h1-2,6,8-9H,3-5,7,12H2.
What are the key properties of 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine?
2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine has a molecular weight of 221.33 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-thiophen-2-ylethyl)imidazol-2-yl]ethanamine is sourced from PubChem (CID 63773737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).