(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine

C8H16F2N2O — CID 169153936

IUPAC(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(CCOC(F)F)C1
InChIInChI=1S/C8H16F2N2O/c9-8(10)13-5-4-12-3-1-2-7(11)6-12/h7-8H,1-6,11H2/t7-/m1/s1
InChIKeyIUXQZQOSFIXFQD-SSDOTTSWSA-N
MW194.22 g/mol
LogP0.65
Rot. Bonds4

About (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine

(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine (PubChem CID 169153936) has the molecular formula C8H16F2N2O and a molecular weight of 194.22 g/mol. Its IUPAC name is (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine
PubChem CID169153936
Molecular FormulaC8H16F2N2O
Molecular Weight194.22 g/mol
Exact Mass194.12
IUPAC Name(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine
SMILESN[C@@H]1CCCN(CCOC(F)F)C1
InChIInChI=1S/C8H16F2N2O/c9-8(10)13-5-4-12-3-1-2-7(11)6-12/h7-8H,1-6,11H2/t7-/m1/s1
InChIKeyIUXQZQOSFIXFQD-SSDOTTSWSA-N
XLogP0.65
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.22
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine?
The IUPAC name of (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine (CID 169153936) is (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine.
What is the SMILES notation for (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine?
The canonical SMILES for (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine is N[C@@H]1CCCN(CCOC(F)F)C1.
What is the InChIKey of (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine?
The InChIKey is IUXQZQOSFIXFQD-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H16F2N2O/c9-8(10)13-5-4-12-3-1-2-7(11)6-12/h7-8H,1-6,11H2/t7-/m1/s1.
What are the key properties of (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine?
(3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine has a molecular weight of 194.22 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[2-(difluoromethoxy)ethyl]piperidin-3-amine is sourced from PubChem (CID 169153936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).