1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine

C14H18FN3O — CID 103949567

IUPAC1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine
SMILESCCC(NCCc1noc(C)n1)c1ccccc1F
InChIInChI=1S/C14H18FN3O/c1-3-13(11-6-4-5-7-12(11)15)16-9-8-14-17-10(2)19-18-14/h4-7,13,16H,3,8-9H2,1-2H3
InChIKeyRYGLJZRUZWGJDV-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.80
Rot. Bonds6

About 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine

1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine (PubChem CID 103949567) has the molecular formula C14H18FN3O and a molecular weight of 263.32 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine
PubChem CID103949567
Molecular FormulaC14H18FN3O
Molecular Weight263.32 g/mol
Exact Mass263.14
IUPAC Name1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine
SMILESCCC(NCCc1noc(C)n1)c1ccccc1F
InChIInChI=1S/C14H18FN3O/c1-3-13(11-6-4-5-7-12(11)15)16-9-8-14-17-10(2)19-18-14/h4-7,13,16H,3,8-9H2,1-2H3
InChIKeyRYGLJZRUZWGJDV-UHFFFAOYSA-N
XLogP2.80
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxyphenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]ethanamine
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1-(2-fluorophenyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]propan-1-amine
CID 103948871
1-(2-fluorophenyl)-N-(3-hydroxysulfanylpropyl)propan-1-amine
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4-fluoro-2-[1-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethylamino]ethyl]phenol
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1-(2-fluorophenyl)-N-[(5-methylthiophen-2-yl)methyl]propan-1-amine
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N-fluoro-1-(2-fluorophenyl)propan-1-amine
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1-(2-methoxyphenyl)-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]propan-1-amine
CID 103901588
1-(2-fluorophenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propan-1-amine
CID 114180016
2-fluoro-N-[1-(2-fluorophenyl)propyl]aniline
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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine?
The IUPAC name of 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine (CID 103949567) is 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine is CCC(NCCc1noc(C)n1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine?
The InChIKey is RYGLJZRUZWGJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O/c1-3-13(11-6-4-5-7-12(11)15)16-9-8-14-17-10(2)19-18-14/h4-7,13,16H,3,8-9H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine?
1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine has a molecular weight of 263.32 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]propan-1-amine is sourced from PubChem (CID 103949567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).