1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine

C8H16F2N2 — CID 176992551

IUPAC1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1CCC(F)(F)CN1
InChIInChI=1S/C8H16F2N2/c1-12(2)5-7-3-4-8(9,10)6-11-7/h7,11H,3-6H2,1-2H3
InChIKeyPNCXMZJDRZJGNO-UHFFFAOYSA-N
MW178.23 g/mol
LogP0.94
Rot. Bonds2

About 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine

1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine (PubChem CID 176992551) has the molecular formula C8H16F2N2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine
PubChem CID176992551
Molecular FormulaC8H16F2N2
Molecular Weight178.23 g/mol
Exact Mass178.13
IUPAC Name1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1CCC(F)(F)CN1
InChIInChI=1S/C8H16F2N2/c1-12(2)5-7-3-4-8(9,10)6-11-7/h7,11H,3-6H2,1-2H3
InChIKeyPNCXMZJDRZJGNO-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine (CID 176992551) is 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine is CN(C)CC1CCC(F)(F)CN1.
What is the InChIKey of 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine?
The InChIKey is PNCXMZJDRZJGNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2/c1-12(2)5-7-3-4-8(9,10)6-11-7/h7,11H,3-6H2,1-2H3.
What are the key properties of 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine?
1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine has a molecular weight of 178.23 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,5-difluoropiperidin-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 176992551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).