4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine

C15H25FN2 — CID 83125502

IUPAC4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine
SMILESCCCCC(CC)CC(C)(N)c1ccc(F)cn1
InChIInChI=1S/C15H25FN2/c1-4-6-7-12(5-2)10-15(3,17)14-9-8-13(16)11-18-14/h8-9,11-12H,4-7,10,17H2,1-3H3
InChIKeyQDXOENKAAYIPCC-UHFFFAOYSA-N
MW252.38 g/mol
LogP4.00
Rot. Bonds7

About 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine

4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine (PubChem CID 83125502) has the molecular formula C15H25FN2 and a molecular weight of 252.38 g/mol. Its IUPAC name is 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine.

Molecular Properties

Compound Name4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine
PubChem CID83125502
Molecular FormulaC15H25FN2
Molecular Weight252.38 g/mol
Exact Mass252.20
IUPAC Name4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine
SMILESCCCCC(CC)CC(C)(N)c1ccc(F)cn1
InChIInChI=1S/C15H25FN2/c1-4-6-7-12(5-2)10-15(3,17)14-9-8-13(16)11-18-14/h8-9,11-12H,4-7,10,17H2,1-3H3
InChIKeyQDXOENKAAYIPCC-UHFFFAOYSA-N
XLogP4.00
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-2-(4-fluorophenyl)octan-2-amine
CID 63408440
2-(5-fluoro-2-pyridinyl)-5,5-dimethylhexan-2-amine
CID 83124633
4-ethyl-2-(2-methylphenyl)octan-2-amine
CID 63408267
3-(5-fluoro-2-pyridinyl)-5-methylhexan-3-amine
CID 112585951
N,3-diethyl-1-(5-fluoro-2-pyridinyl)heptan-1-amine
CID 79712767
2-(5-fluoro-2-pyridinyl)-1-thiophen-2-ylpropan-2-amine
CID 83124945
2-(5-fluoro-2-pyridinyl)-1-pyridin-2-ylpropan-2-amine
CID 83126041
1-cyclohexyl-2-(5-fluoro-2-pyridinyl)propan-2-amine
CID 83125019
1-(4-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 83124710
2-(5-fluoro-2-pyridinyl)butan-2-ol
CID 83124844
N-(2-ethylhexyl)-6-nitropyridin-3-amine
CID 103614336
1-(2,5-dimethylphenyl)-2-(5-fluoro-2-pyridinyl)propan-2-amine
CID 83125513

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine?
The IUPAC name of 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine (CID 83125502) is 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine.
What is the SMILES notation for 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine?
The canonical SMILES for 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine is CCCCC(CC)CC(C)(N)c1ccc(F)cn1.
What is the InChIKey of 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine?
The InChIKey is QDXOENKAAYIPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FN2/c1-4-6-7-12(5-2)10-15(3,17)14-9-8-13(16)11-18-14/h8-9,11-12H,4-7,10,17H2,1-3H3.
What are the key properties of 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine?
4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine has a molecular weight of 252.38 g/mol, XLogP of 4.00, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(5-fluoro-2-pyridinyl)octan-2-amine is sourced from PubChem (CID 83125502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).