1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine

C15H18FNS — CID 63008178

IUPAC1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine
SMILESCC(Cc1ccc(F)cc1)NC(C)c1ccsc1
InChIInChI=1S/C15H18FNS/c1-11(9-13-3-5-15(16)6-4-13)17-12(2)14-7-8-18-10-14/h3-8,10-12,17H,9H2,1-2H3
InChIKeyJZZOXXOENNQEHB-UHFFFAOYSA-N
MW263.38 g/mol
LogP4.17
Rot. Bonds5

About 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine

1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine (PubChem CID 63008178) has the molecular formula C15H18FNS and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine
PubChem CID63008178
Molecular FormulaC15H18FNS
Molecular Weight263.38 g/mol
Exact Mass263.11
IUPAC Name1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine
SMILESCC(Cc1ccc(F)cc1)NC(C)c1ccsc1
InChIInChI=1S/C15H18FNS/c1-11(9-13-3-5-15(16)6-4-13)17-12(2)14-7-8-18-10-14/h3-8,10-12,17H,9H2,1-2H3
InChIKeyJZZOXXOENNQEHB-UHFFFAOYSA-N
XLogP4.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-N-[1-(4-methylphenyl)ethyl]propan-2-amine
CID 63008352
1-(4-bromophenyl)-N-[1-(4-fluorophenyl)ethyl]propan-2-amine
CID 43695926
1-thiophen-3-yl-N-(1-thiophen-3-ylethyl)ethanamine
CID 14249916
1-(4-fluorophenyl)-N-[(1R)-1-thiophen-2-ylethyl]propan-2-amine
CID 104979816
N-[1-(3,4-difluorophenyl)ethyl]-1-(4-fluorophenyl)propan-2-amine
CID 63008182
1-(4-fluorophenyl)-N-(1-thiophen-3-ylpropan-2-yl)propan-1-amine
CID 61473211
[2-(4-fluorophenyl)-1-thiophen-3-ylethyl]hydrazine
CID 105196708
N-[1-(2,5-difluorophenyl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 61472940
3-(1-thiophen-3-ylethylamino)butan-1-ol
CID 81338166
1-(2-chlorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine
CID 62089455
N-(1-thiophen-3-ylethyl)pent-4-yn-2-amine
CID 115725339
N-(1-pyridin-4-ylethyl)-1-thiophen-3-ylpropan-2-amine
CID 54952734

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine (CID 63008178) is 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine is CC(Cc1ccc(F)cc1)NC(C)c1ccsc1.
What is the InChIKey of 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine?
The InChIKey is JZZOXXOENNQEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNS/c1-11(9-13-3-5-15(16)6-4-13)17-12(2)14-7-8-18-10-14/h3-8,10-12,17H,9H2,1-2H3.
What are the key properties of 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine?
1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine has a molecular weight of 263.38 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-N-(1-thiophen-3-ylethyl)propan-2-amine is sourced from PubChem (CID 63008178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).