3-fluoropiperidin-4-amine

C5H11FN2 — CID 18938991

IUPAC3-fluoropiperidin-4-amine
SMILESNC1CCNCC1F
InChIInChI=1S/C5H11FN2/c6-4-3-8-2-1-5(4)7/h4-5,8H,1-3,7H2
InChIKeyDEVLCRJHRJHMCX-UHFFFAOYSA-N
MW118.16 g/mol
LogP-0.35
Rot. Bonds

About 3-fluoropiperidin-4-amine

3-fluoropiperidin-4-amine (PubChem CID 18938991) has the molecular formula C5H11FN2 and a molecular weight of 118.16 g/mol. Its IUPAC name is 3-fluoropiperidin-4-amine.

Molecular Properties

Compound Name3-fluoropiperidin-4-amine
PubChem CID18938991
Molecular FormulaC5H11FN2
Molecular Weight118.16 g/mol
Exact Mass118.09
IUPAC Name3-fluoropiperidin-4-amine
SMILESNC1CCNCC1F
InChIInChI=1S/C5H11FN2/c6-4-3-8-2-1-5(4)7/h4-5,8H,1-3,7H2
InChIKeyDEVLCRJHRJHMCX-UHFFFAOYSA-N
XLogP-0.35
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.16
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoropiperidin-4-amine?
The IUPAC name of 3-fluoropiperidin-4-amine (CID 18938991) is 3-fluoropiperidin-4-amine.
What is the SMILES notation for 3-fluoropiperidin-4-amine?
The canonical SMILES for 3-fluoropiperidin-4-amine is NC1CCNCC1F.
What is the InChIKey of 3-fluoropiperidin-4-amine?
The InChIKey is DEVLCRJHRJHMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2/c6-4-3-8-2-1-5(4)7/h4-5,8H,1-3,7H2.
What are the key properties of 3-fluoropiperidin-4-amine?
3-fluoropiperidin-4-amine has a molecular weight of 118.16 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoropiperidin-4-amine is sourced from PubChem (CID 18938991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).