1-(2,2-difluoroethyl)-4-propylpiperidine

C10H19F2N — CID 89323946

IUPAC1-(2,2-difluoroethyl)-4-propylpiperidine
SMILESCCCC1CCN(CC(F)F)CC1
InChIInChI=1S/C10H19F2N/c1-2-3-9-4-6-13(7-5-9)8-10(11)12/h9-10H,2-8H2,1H3
InChIKeyQCQFORZHPXAQIC-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.76
Rot. Bonds4

About 1-(2,2-difluoroethyl)-4-propylpiperidine

1-(2,2-difluoroethyl)-4-propylpiperidine (PubChem CID 89323946) has the molecular formula C10H19F2N and a molecular weight of 191.26 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-4-propylpiperidine.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-4-propylpiperidine
PubChem CID89323946
Molecular FormulaC10H19F2N
Molecular Weight191.26 g/mol
Exact Mass191.15
IUPAC Name1-(2,2-difluoroethyl)-4-propylpiperidine
SMILESCCCC1CCN(CC(F)F)CC1
InChIInChI=1S/C10H19F2N/c1-2-3-9-4-6-13(7-5-9)8-10(11)12/h9-10H,2-8H2,1H3
InChIKeyQCQFORZHPXAQIC-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,1,1-trifluoro-3-(4-propylpiperidin-1-yl)propan-2-ol
CID 63902467
1-(2,2-difluoroethyl)-4-pentan-2-ylpiperidine
CID 167291149
3,3-dimethyl-1-(4-propylpiperidin-1-yl)butan-2-ol
CID 62205780
1-(2,2-diethoxyethyl)-4-propylpiperidine
CID 63617165
1-(2,2-difluoroethyl)-3-ethylpyrrolidine;ethane
CID 169182399
1-amino-3-(4-propylpiperidin-1-yl)propan-2-ol
CID 62200170
[1-(2,2-difluoroethyl)piperidin-4-yl]methanamine;dihydrochloride
CID 119031603
1-(4-fluorophenyl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 107520786
1-cyclopentyl-2-(4-propylpiperidin-1-yl)ethanol
CID 104752787
3-methyl-4-(4-propylpiperidin-1-yl)butan-1-amine
CID 80544082
1-(4-propylpiperidin-1-yl)propane-2-sulfinate
CID 174657453
2-methyl-3-(4-propylpiperidin-1-yl)propanethioamide
CID 62199637

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-4-propylpiperidine?
The IUPAC name of 1-(2,2-difluoroethyl)-4-propylpiperidine (CID 89323946) is 1-(2,2-difluoroethyl)-4-propylpiperidine.
What is the SMILES notation for 1-(2,2-difluoroethyl)-4-propylpiperidine?
The canonical SMILES for 1-(2,2-difluoroethyl)-4-propylpiperidine is CCCC1CCN(CC(F)F)CC1.
What is the InChIKey of 1-(2,2-difluoroethyl)-4-propylpiperidine?
The InChIKey is QCQFORZHPXAQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2N/c1-2-3-9-4-6-13(7-5-9)8-10(11)12/h9-10H,2-8H2,1H3.
What are the key properties of 1-(2,2-difluoroethyl)-4-propylpiperidine?
1-(2,2-difluoroethyl)-4-propylpiperidine has a molecular weight of 191.26 g/mol, XLogP of 2.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-4-propylpiperidine is sourced from PubChem (CID 89323946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).