1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine

C14H16FNOS — CID 55019874

IUPAC1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine
SMILESCC(N)C(OCc1cccs1)c1cccc(F)c1
InChIInChI=1S/C14H16FNOS/c1-10(16)14(11-4-2-5-12(15)8-11)17-9-13-6-3-7-18-13/h2-8,10,14H,9,16H2,1H3
InChIKeyYEDWRULBGZMSBQ-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.49
Rot. Bonds5

About 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine

1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine (PubChem CID 55019874) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine.

Molecular Properties

Compound Name1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine
PubChem CID55019874
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine
SMILESCC(N)C(OCc1cccs1)c1cccc(F)c1
InChIInChI=1S/C14H16FNOS/c1-10(16)14(11-4-2-5-12(15)8-11)17-9-13-6-3-7-18-13/h2-8,10,14H,9,16H2,1H3
InChIKeyYEDWRULBGZMSBQ-UHFFFAOYSA-N
XLogP3.49
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluorophenyl)-1-octoxypropan-2-amine
CID 63459739
1-(3-fluorophenyl)-1-(oxan-4-ylmethoxy)propan-2-amine
CID 55066001
1-phenyl-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55017191
1-(cyclohexylmethoxy)-1-(3-fluorophenyl)propan-2-amine
CID 62382003
1-(3-fluorophenyl)-N-(1-thiophen-2-ylpropan-2-yl)propan-1-amine
CID 114871253
1-(3-fluorophenyl)-1-[3-(2-methoxyethoxy)propoxy]propan-2-amine
CID 103401330
[1-(3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105193135
2-[3-chloro-2-(3-fluorophenyl)propyl]thiophene
CID 79431470
(1S)-1-[3-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 78933301
1-[3-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 43504299
(1S)-1-[4-fluoro-2-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 78932180
1-(3-ethoxyphenoxy)-1-(3-fluorophenyl)propan-2-amine
CID 62338448

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine?
The IUPAC name of 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine (CID 55019874) is 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine.
What is the SMILES notation for 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine?
The canonical SMILES for 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine is CC(N)C(OCc1cccs1)c1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine?
The InChIKey is YEDWRULBGZMSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-10(16)14(11-4-2-5-12(15)8-11)17-9-13-6-3-7-18-13/h2-8,10,14H,9,16H2,1H3.
What are the key properties of 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine?
1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine has a molecular weight of 265.35 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-1-(thiophen-2-ylmethoxy)propan-2-amine is sourced from PubChem (CID 55019874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).