N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine

C9H14FNS — CID 80694035

IUPACN-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine
SMILESCC(Cc1ccsc1)NCCF
InChIInChI=1S/C9H14FNS/c1-8(11-4-3-10)6-9-2-5-12-7-9/h2,5,7-8,11H,3-4,6H2,1H3
InChIKeyHVVGLWCFAMNJPB-UHFFFAOYSA-N
MW187.28 g/mol
LogP2.24
Rot. Bonds5

About N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine

N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine (PubChem CID 80694035) has the molecular formula C9H14FNS and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine
PubChem CID80694035
Molecular FormulaC9H14FNS
Molecular Weight187.28 g/mol
Exact Mass187.08
IUPAC NameN-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine
SMILESCC(Cc1ccsc1)NCCF
InChIInChI=1S/C9H14FNS/c1-8(11-4-3-10)6-9-2-5-12-7-9/h2,5,7-8,11H,3-4,6H2,1H3
InChIKeyHVVGLWCFAMNJPB-UHFFFAOYSA-N
XLogP2.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-(1-thiophen-3-ylpropan-2-yl)but-3-en-1-amine
CID 114472154
6-(1-thiophen-3-ylpropan-2-ylamino)hexan-1-ol
CID 115906776
N'-methyl-N'-propan-2-yl-N-(1-thiophen-3-ylpropan-2-yl)ethane-1,2-diamine
CID 115715971
N-[2-(3-methylbutoxy)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 54956098
1-thiophen-3-yl-N-[3-(2,2,2-trifluoroethoxy)propyl]propan-2-amine
CID 54961663
N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 115731927
(E)-N-(1-thiophen-3-ylpropan-2-yl)but-2-en-1-amine
CID 107898855
N-[(3,4-dimethylphenyl)methyl]-1-thiophen-3-ylpropan-2-amine
CID 61223934
N-[2-(cyclopenten-1-yl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 115895883
1-thiophen-3-yl-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]propan-2-amine
CID 84589401
3-(2-fluoropropyl)thiophene
CID 74766003
1-thiophen-3-yl-N-(thiophen-2-ylmethyl)propan-2-amine
CID 61222092

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine?
The IUPAC name of N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine (CID 80694035) is N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine is CC(Cc1ccsc1)NCCF.
What is the InChIKey of N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine?
The InChIKey is HVVGLWCFAMNJPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FNS/c1-8(11-4-3-10)6-9-2-5-12-7-9/h2,5,7-8,11H,3-4,6H2,1H3.
What are the key properties of N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine?
N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine has a molecular weight of 187.28 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-1-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 80694035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).