1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine

C15H23FN2 — CID 83117695

IUPAC1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine
SMILESCC(NCC1CCCCC1C)c1ccc(F)cn1
InChIInChI=1S/C15H23FN2/c1-11-5-3-4-6-13(11)9-17-12(2)15-8-7-14(16)10-18-15/h7-8,10-13,17H,3-6,9H2,1-2H3
InChIKeyCLUBGOKSZSDOEW-UHFFFAOYSA-N
MW250.36 g/mol
LogP3.70
Rot. Bonds4

About 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine

1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine (PubChem CID 83117695) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine
PubChem CID83117695
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine
SMILESCC(NCC1CCCCC1C)c1ccc(F)cn1
InChIInChI=1S/C15H23FN2/c1-11-5-3-4-6-13(11)9-17-12(2)15-8-7-14(16)10-18-15/h7-8,10-13,17H,3-6,9H2,1-2H3
InChIKeyCLUBGOKSZSDOEW-UHFFFAOYSA-N
XLogP3.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 83119895
1-(2,4-difluorophenyl)-N-[(2-methylcyclohexyl)methyl]ethanamine
CID 63453969
5-fluoro-2-[1-[(2-methylcyclopentyl)methylamino]ethyl]phenol
CID 107417292
(1S)-1-cycloheptyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83120103
2,2-difluoro-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83119275
N-[(2-methylcyclohexyl)methyl]-1-(3-methylpyrazin-2-yl)ethanamine
CID 102612549
N-[1-(5-fluoro-2-pyridinyl)ethyl]but-2-yn-1-amine
CID 115896973
1-cyclopropyl-N-[1-(5-fluoro-2-pyridinyl)ethyl]ethanamine
CID 83117431
3-[1-(5-fluoro-2-pyridinyl)ethylamino]propan-1-ol
CID 83117272
N-[(2-methylcyclopentyl)methyl]-1-phenylethanamine
CID 107417351
N-[1-(5-fluoro-2-pyridinyl)ethyl]-2-methylbutan-1-amine
CID 83120285
5-fluoro-N-[(2-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 107419346

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine (CID 83117695) is 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine is CC(NCC1CCCCC1C)c1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine?
The InChIKey is CLUBGOKSZSDOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-11-5-3-4-6-13(11)9-17-12(2)15-8-7-14(16)10-18-15/h7-8,10-13,17H,3-6,9H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine?
1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine has a molecular weight of 250.36 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-N-[(2-methylcyclohexyl)methyl]ethanamine is sourced from PubChem (CID 83117695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).