2-[(Z)-but-2-en-2-yl]thiophen-3-amine

C8H11NS — CID 58028346

IUPAC2-[(Z)-but-2-en-2-yl]thiophen-3-amine
SMILESC/C=C(/C)c1sccc1N
InChIInChI=1S/C8H11NS/c1-3-6(2)8-7(9)4-5-10-8/h3-5H,9H2,1-2H3/b6-3-
InChIKeyQECIFZPLLCRHBK-UTCJRWHESA-N
MW153.25 g/mol
LogP2.75
Rot. Bonds1

About 2-[(Z)-but-2-en-2-yl]thiophen-3-amine

2-[(Z)-but-2-en-2-yl]thiophen-3-amine (PubChem CID 58028346) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 2-[(Z)-but-2-en-2-yl]thiophen-3-amine.

Molecular Properties

Compound Name2-[(Z)-but-2-en-2-yl]thiophen-3-amine
PubChem CID58028346
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name2-[(Z)-but-2-en-2-yl]thiophen-3-amine
SMILESC/C=C(/C)c1sccc1N
InChIInChI=1S/C8H11NS/c1-3-6(2)8-7(9)4-5-10-8/h3-5H,9H2,1-2H3/b6-3-
InChIKeyQECIFZPLLCRHBK-UTCJRWHESA-N
XLogP2.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-but-2-en-2-yl]thiophen-3-amine?
The IUPAC name of 2-[(Z)-but-2-en-2-yl]thiophen-3-amine (CID 58028346) is 2-[(Z)-but-2-en-2-yl]thiophen-3-amine.
What is the SMILES notation for 2-[(Z)-but-2-en-2-yl]thiophen-3-amine?
The canonical SMILES for 2-[(Z)-but-2-en-2-yl]thiophen-3-amine is C/C=C(/C)c1sccc1N.
What is the InChIKey of 2-[(Z)-but-2-en-2-yl]thiophen-3-amine?
The InChIKey is QECIFZPLLCRHBK-UTCJRWHESA-N. The full InChI is InChI=1S/C8H11NS/c1-3-6(2)8-7(9)4-5-10-8/h3-5H,9H2,1-2H3/b6-3-.
What are the key properties of 2-[(Z)-but-2-en-2-yl]thiophen-3-amine?
2-[(Z)-but-2-en-2-yl]thiophen-3-amine has a molecular weight of 153.25 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-but-2-en-2-yl]thiophen-3-amine is sourced from PubChem (CID 58028346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).