2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine

C11H23FN2 — CID 105454874

IUPAC2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine
SMILESCC(C)(C)N1CCCC(C(F)CN)C1
InChIInChI=1S/C11H23FN2/c1-11(2,3)14-6-4-5-9(8-14)10(12)7-13/h9-10H,4-8,13H2,1-3H3
InChIKeyOXXBGAIAYJGHNZ-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.79
Rot. Bonds2

About 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine

2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine (PubChem CID 105454874) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine.

Molecular Properties

Compound Name2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine
PubChem CID105454874
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine
SMILESCC(C)(C)N1CCCC(C(F)CN)C1
InChIInChI=1S/C11H23FN2/c1-11(2,3)14-6-4-5-9(8-14)10(12)7-13/h9-10H,4-8,13H2,1-3H3
InChIKeyOXXBGAIAYJGHNZ-UHFFFAOYSA-N
XLogP1.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-tert-butyl-3-(difluoromethyl)piperidine
CID 176615633
2-cyclobutyl-2-fluoroethanamine
CID 84716016
(1-tert-butylazepan-3-yl)methanamine
CID 84659780
1-(1-tert-butylpyrrolidin-3-yl)-2-fluoroethanol
CID 66815505
1-tert-butyl-3-(2-methylpropyl)piperidine
CID 170069578
2-[(S)-[(3R)-1-tert-butylpiperidin-3-yl]-(3-chloro-2-fluorophenyl)methoxy]ethanamine
CID 69261997
1-tert-butyl-3-(2,3,3-trimethylbutyl)piperidine
CID 176842011
1,3-ditert-butylpiperidine;methane
CID 157116364
(3R)-1-tert-butyl-3-propylpiperidine
CID 171581901
1-tert-butylpiperidine-3-carboxamide
CID 59656300
1-tert-butyl-3-(2-iodopropan-2-yl)piperidine
CID 170043848
2-(aminomethyl)-N-(1-tert-butylpiperidin-4-yl)-3-methylbutanamide
CID 65230009

Frequently Asked Questions

What is the IUPAC name of 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine?
The IUPAC name of 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine (CID 105454874) is 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine.
What is the SMILES notation for 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine?
The canonical SMILES for 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine is CC(C)(C)N1CCCC(C(F)CN)C1.
What is the InChIKey of 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine?
The InChIKey is OXXBGAIAYJGHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-11(2,3)14-6-4-5-9(8-14)10(12)7-13/h9-10H,4-8,13H2,1-3H3.
What are the key properties of 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine?
2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine has a molecular weight of 202.32 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-tert-butylpiperidin-3-yl)-2-fluoroethanamine is sourced from PubChem (CID 105454874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).