1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine

C9H19FN2 — CID 163295998

IUPAC1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine
SMILESCC1(C)CC(N)CCN1CCF
InChIInChI=1S/C9H19FN2/c1-9(2)7-8(11)3-5-12(9)6-4-10/h8H,3-7,11H2,1-2H3
InChIKeyRMVRKNSYIFLUKW-UHFFFAOYSA-N
MW174.26 g/mol
LogP1.16
Rot. Bonds2

About 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine

1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine (PubChem CID 163295998) has the molecular formula C9H19FN2 and a molecular weight of 174.26 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine
PubChem CID163295998
Molecular FormulaC9H19FN2
Molecular Weight174.26 g/mol
Exact Mass174.15
IUPAC Name1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine
SMILESCC1(C)CC(N)CCN1CCF
InChIInChI=1S/C9H19FN2/c1-9(2)7-8(11)3-5-12(9)6-4-10/h8H,3-7,11H2,1-2H3
InChIKeyRMVRKNSYIFLUKW-UHFFFAOYSA-N
XLogP1.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine?
The IUPAC name of 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine (CID 163295998) is 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine is CC1(C)CC(N)CCN1CCF.
What is the InChIKey of 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine?
The InChIKey is RMVRKNSYIFLUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2/c1-9(2)7-8(11)3-5-12(9)6-4-10/h8H,3-7,11H2,1-2H3.
What are the key properties of 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine?
1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine has a molecular weight of 174.26 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-2,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 163295998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).