2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine

C9H19FN2 — CID 84654963

IUPAC2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine
SMILESCC(F)(CN)CN1CCCCC1
InChIInChI=1S/C9H19FN2/c1-9(10,7-11)8-12-5-3-2-4-6-12/h2-8,11H2,1H3
InChIKeyMBSSUJZFYHWQMR-UHFFFAOYSA-N
MW174.26 g/mol
LogP1.16
Rot. Bonds3

About 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine

2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine (PubChem CID 84654963) has the molecular formula C9H19FN2 and a molecular weight of 174.26 g/mol. Its IUPAC name is 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine
PubChem CID84654963
Molecular FormulaC9H19FN2
Molecular Weight174.26 g/mol
Exact Mass174.15
IUPAC Name2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine
SMILESCC(F)(CN)CN1CCCCC1
InChIInChI=1S/C9H19FN2/c1-9(10,7-11)8-12-5-3-2-4-6-12/h2-8,11H2,1H3
InChIKeyMBSSUJZFYHWQMR-UHFFFAOYSA-N
XLogP1.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine?
The IUPAC name of 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine (CID 84654963) is 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine?
The canonical SMILES for 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine is CC(F)(CN)CN1CCCCC1.
What is the InChIKey of 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine?
The InChIKey is MBSSUJZFYHWQMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2/c1-9(10,7-11)8-12-5-3-2-4-6-12/h2-8,11H2,1H3.
What are the key properties of 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine?
2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine has a molecular weight of 174.26 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methyl-3-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 84654963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).