1-(1-fluoropropyl)piperidin-4-amine

C8H17FN2 — CID 68908294

IUPAC1-(1-fluoropropyl)piperidin-4-amine
SMILESCCC(F)N1CCC(N)CC1
InChIInChI=1S/C8H17FN2/c1-2-8(9)11-5-3-7(10)4-6-11/h7-8H,2-6,10H2,1H3
InChIKeyMCBAJGWFPXSRCO-UHFFFAOYSA-N
MW160.24 g/mol
LogP1.12
Rot. Bonds2

About 1-(1-fluoropropyl)piperidin-4-amine

1-(1-fluoropropyl)piperidin-4-amine (PubChem CID 68908294) has the molecular formula C8H17FN2 and a molecular weight of 160.24 g/mol. Its IUPAC name is 1-(1-fluoropropyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(1-fluoropropyl)piperidin-4-amine
PubChem CID68908294
Molecular FormulaC8H17FN2
Molecular Weight160.24 g/mol
Exact Mass160.14
IUPAC Name1-(1-fluoropropyl)piperidin-4-amine
SMILESCCC(F)N1CCC(N)CC1
InChIInChI=1S/C8H17FN2/c1-2-8(9)11-5-3-7(10)4-6-11/h7-8H,2-6,10H2,1H3
InChIKeyMCBAJGWFPXSRCO-UHFFFAOYSA-N
XLogP1.12
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.24
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-fluoropropyl)piperidin-4-amine?
The IUPAC name of 1-(1-fluoropropyl)piperidin-4-amine (CID 68908294) is 1-(1-fluoropropyl)piperidin-4-amine.
What is the SMILES notation for 1-(1-fluoropropyl)piperidin-4-amine?
The canonical SMILES for 1-(1-fluoropropyl)piperidin-4-amine is CCC(F)N1CCC(N)CC1.
What is the InChIKey of 1-(1-fluoropropyl)piperidin-4-amine?
The InChIKey is MCBAJGWFPXSRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2/c1-2-8(9)11-5-3-7(10)4-6-11/h7-8H,2-6,10H2,1H3.
What are the key properties of 1-(1-fluoropropyl)piperidin-4-amine?
1-(1-fluoropropyl)piperidin-4-amine has a molecular weight of 160.24 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-fluoropropyl)piperidin-4-amine is sourced from PubChem (CID 68908294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).