N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine

C14H16FNOS — CID 115792372

IUPACN-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
SMILESCCNC(c1cccc(F)c1)c1sccc1OC
InChIInChI=1S/C14H16FNOS/c1-3-16-13(10-5-4-6-11(15)9-10)14-12(17-2)7-8-18-14/h4-9,13,16H,3H2,1-2H3
InChIKeyATPRJPJJOVKQSV-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.59
Rot. Bonds5

About N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine

N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine (PubChem CID 115792372) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
PubChem CID115792372
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC NameN-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
SMILESCCNC(c1cccc(F)c1)c1sccc1OC
InChIInChI=1S/C14H16FNOS/c1-3-16-13(10-5-4-6-11(15)9-10)14-12(17-2)7-8-18-14/h4-9,13,16H,3H2,1-2H3
InChIKeyATPRJPJJOVKQSV-UHFFFAOYSA-N
XLogP3.59
TPSA21.26 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 ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluoro-2-methylphenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
CID 115852574
N-[(4-chloro-3-methoxyphenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
CID 105007145
(3-fluorophenyl)-(3-methoxythiophen-2-yl)methanamine
CID 115791862
N-[(4-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]propan-1-amine
CID 81127501
N-[(3-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]ethanamine
CID 55007060
N-[(3-fluoro-4-methylphenyl)-(3-methoxythiophen-2-yl)methyl]propan-1-amine
CID 107130279
N-[(3,5-dimethylthiophen-2-yl)-(3-fluorophenyl)methyl]ethanamine
CID 81156037
N-[(3-chlorothiophen-2-yl)-(3-methoxyphenyl)methyl]ethanamine
CID 80529194
N-[(2,3-dichlorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
CID 115851457
[(3-ethylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine
CID 105326396
2-(2-bromo-5-fluorophenyl)-N-ethyl-1-(3-methoxythiophen-2-yl)ethanamine
CID 115843885
N-[(2-methoxy-5-methylphenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine
CID 81127182

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine?
The IUPAC name of N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine (CID 115792372) is N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine is CCNC(c1cccc(F)c1)c1sccc1OC.
What is the InChIKey of N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine?
The InChIKey is ATPRJPJJOVKQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-3-16-13(10-5-4-6-11(15)9-10)14-12(17-2)7-8-18-14/h4-9,13,16H,3H2,1-2H3.
What are the key properties of N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine?
N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine has a molecular weight of 265.35 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)-(3-methoxythiophen-2-yl)methyl]ethanamine is sourced from PubChem (CID 115792372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).