3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine

C8H15FN2 — CID 89294562

IUPAC3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine
SMILESC=C(N)CN1CCCC(F)C1
InChIInChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h8H,1-6,10H2
InChIKeyJVZAXPVECPRBGH-UHFFFAOYSA-N
MW158.22 g/mol
LogP0.89
Rot. Bonds2

About 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine

3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine (PubChem CID 89294562) has the molecular formula C8H15FN2 and a molecular weight of 158.22 g/mol. Its IUPAC name is 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine.

Molecular Properties

Compound Name3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine
PubChem CID89294562
Molecular FormulaC8H15FN2
Molecular Weight158.22 g/mol
Exact Mass158.12
IUPAC Name3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine
SMILESC=C(N)CN1CCCC(F)C1
InChIInChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h8H,1-6,10H2
InChIKeyJVZAXPVECPRBGH-UHFFFAOYSA-N
XLogP0.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.22
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine?
The IUPAC name of 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine (CID 89294562) is 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine.
What is the SMILES notation for 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine?
The canonical SMILES for 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine is C=C(N)CN1CCCC(F)C1.
What is the InChIKey of 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine?
The InChIKey is JVZAXPVECPRBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FN2/c1-7(10)5-11-4-2-3-8(9)6-11/h8H,1-6,10H2.
What are the key properties of 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine?
3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine has a molecular weight of 158.22 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoropiperidin-1-yl)prop-1-en-2-amine is sourced from PubChem (CID 89294562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).