(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine

C7H8FNS — CID 19789973

IUPAC(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine
SMILESNC/C(=C\F)c1cccs1
InChIInChI=1S/C7H8FNS/c8-4-6(5-9)7-2-1-3-10-7/h1-4H,5,9H2/b6-4+
InChIKeyLXDXLBLQFHBXCA-GQCTYLIASA-N
MW157.21 g/mol
LogP2.02
Rot. Bonds2

About (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine

(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine (PubChem CID 19789973) has the molecular formula C7H8FNS and a molecular weight of 157.21 g/mol. Its IUPAC name is (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine.

Molecular Properties

Compound Name(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine
PubChem CID19789973
Molecular FormulaC7H8FNS
Molecular Weight157.21 g/mol
Exact Mass157.04
IUPAC Name(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine
SMILESNC/C(=C\F)c1cccs1
InChIInChI=1S/C7H8FNS/c8-4-6(5-9)7-2-1-3-10-7/h1-4H,5,9H2/b6-4+
InChIKeyLXDXLBLQFHBXCA-GQCTYLIASA-N
XLogP2.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine?
The IUPAC name of (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine (CID 19789973) is (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine.
What is the SMILES notation for (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine?
The canonical SMILES for (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine is NC/C(=C\F)c1cccs1.
What is the InChIKey of (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine?
The InChIKey is LXDXLBLQFHBXCA-GQCTYLIASA-N. The full InChI is InChI=1S/C7H8FNS/c8-4-6(5-9)7-2-1-3-10-7/h1-4H,5,9H2/b6-4+.
What are the key properties of (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine?
(E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine has a molecular weight of 157.21 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoro-2-thiophen-2-ylprop-2-en-1-amine is sourced from PubChem (CID 19789973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).