2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine

C9H11N3S — CID 11819933

IUPAC2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine
SMILESNCCc1cnc(-c2cccs2)[nH]1
InChIInChI=1S/C9H11N3S/c10-4-3-7-6-11-9(12-7)8-2-1-5-13-8/h1-2,5-6H,3-4,10H2,(H,11,12)
InChIKeyPIPAANKHOPUKHR-UHFFFAOYSA-N
MW193.28 g/mol
LogP1.64
Rot. Bonds3

About 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine

2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine (PubChem CID 11819933) has the molecular formula C9H11N3S and a molecular weight of 193.28 g/mol. Its IUPAC name is 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine
PubChem CID11819933
Molecular FormulaC9H11N3S
Molecular Weight193.28 g/mol
Exact Mass193.07
IUPAC Name2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine
SMILESNCCc1cnc(-c2cccs2)[nH]1
InChIInChI=1S/C9H11N3S/c10-4-3-7-6-11-9(12-7)8-2-1-5-13-8/h1-2,5-6H,3-4,10H2,(H,11,12)
InChIKeyPIPAANKHOPUKHR-UHFFFAOYSA-N
XLogP1.64
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.28
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-Imidazol-4-ylmethyl)-4-phenyl-thiazole
CID 14742545
5-[(3-methylthiophen-2-yl)methyl]-1H-imidazole;hydrochloride
CID 9837284
5-[1-(3-methylthiophen-2-yl)ethyl]-1H-imidazole
CID 10487999
5-[(3-bromothiophen-2-yl)methyl]-1H-imidazole;hydrochloride
CID 19961016
4-[(thiophen-2-yl)methyl]-1H-imidazole hydrochloride
CID 49861211
6-(thiophen-2-yl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538802
N-[2-(1H-imidazol-4-yl)ethyl]-2-thiophenecarboxamide
CID 6457652
6,7-Dihydro-4-(1H-imidazole-4-yl)benzo[b]thiophene
CID 9815610
4-(4,5-Dihydro-benzo[b]thiophen-7-yl)-1H-imidazole
CID 9837106
2-{[2-(1H-Imidazol-4-yl)ethyl]thio}pyridine
CID 10398042
2-[3-(1H-imidazol-5-yl)propyl]-1-(3-pyridin-2-yl-3-thiophen-2-ylpropyl)guanidine
CID 14660411
5-[(4-bromothiophen-2-yl)methyl]-1H-imidazole;hydrochloride
CID 19961015

Frequently Asked Questions

What is the IUPAC name of 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine?
The IUPAC name of 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine (CID 11819933) is 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine.
What is the SMILES notation for 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine?
The canonical SMILES for 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine is NCCc1cnc(-c2cccs2)[nH]1.
What is the InChIKey of 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine?
The InChIKey is PIPAANKHOPUKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3S/c10-4-3-7-6-11-9(12-7)8-2-1-5-13-8/h1-2,5-6H,3-4,10H2,(H,11,12).
What are the key properties of 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine?
2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine has a molecular weight of 193.28 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-thiophen-2-yl-1H-imidazol-5-yl)ethanamine is sourced from PubChem (CID 11819933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).