N-(2,2-difluoroethyl)thiophen-3-amine

C6H7F2NS — CID 66349735

IUPACN-(2,2-difluoroethyl)thiophen-3-amine
SMILESFC(F)CNc1ccsc1
InChIInChI=1S/C6H7F2NS/c7-6(8)3-9-5-1-2-10-4-5/h1-2,4,6,9H,3H2
InChIKeyRAKGBQDOYNTUQK-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.43
Rot. Bonds3

About N-(2,2-difluoroethyl)thiophen-3-amine

N-(2,2-difluoroethyl)thiophen-3-amine (PubChem CID 66349735) has the molecular formula C6H7F2NS and a molecular weight of 163.19 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)thiophen-3-amine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)thiophen-3-amine
PubChem CID66349735
Molecular FormulaC6H7F2NS
Molecular Weight163.19 g/mol
Exact Mass163.03
IUPAC NameN-(2,2-difluoroethyl)thiophen-3-amine
SMILESFC(F)CNc1ccsc1
InChIInChI=1S/C6H7F2NS/c7-6(8)3-9-5-1-2-10-4-5/h1-2,4,6,9H,3H2
InChIKeyRAKGBQDOYNTUQK-UHFFFAOYSA-N
XLogP2.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)thiophen-3-amine?
The IUPAC name of N-(2,2-difluoroethyl)thiophen-3-amine (CID 66349735) is N-(2,2-difluoroethyl)thiophen-3-amine.
What is the SMILES notation for N-(2,2-difluoroethyl)thiophen-3-amine?
The canonical SMILES for N-(2,2-difluoroethyl)thiophen-3-amine is FC(F)CNc1ccsc1.
What is the InChIKey of N-(2,2-difluoroethyl)thiophen-3-amine?
The InChIKey is RAKGBQDOYNTUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F2NS/c7-6(8)3-9-5-1-2-10-4-5/h1-2,4,6,9H,3H2.
What are the key properties of N-(2,2-difluoroethyl)thiophen-3-amine?
N-(2,2-difluoroethyl)thiophen-3-amine has a molecular weight of 163.19 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)thiophen-3-amine is sourced from PubChem (CID 66349735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).