2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine

C10H20F2N2 — CID 84674393

IUPAC2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
SMILESCN(CC1CCCNC1)CC(C)(F)F
InChIInChI=1S/C10H20F2N2/c1-10(11,12)8-14(2)7-9-4-3-5-13-6-9/h9,13H,3-8H2,1-2H3
InChIKeyGGCYCPPZWUETDR-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.57
Rot. Bonds4

About 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine

2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine (PubChem CID 84674393) has the molecular formula C10H20F2N2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
PubChem CID84674393
Molecular FormulaC10H20F2N2
Molecular Weight206.28 g/mol
Exact Mass206.16
IUPAC Name2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
SMILESCN(CC1CCCNC1)CC(C)(F)F
InChIInChI=1S/C10H20F2N2/c1-10(11,12)8-14(2)7-9-4-3-5-13-6-9/h9,13H,3-8H2,1-2H3
InChIKeyGGCYCPPZWUETDR-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
3,3-difluoro-N-methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine
CID 84674397
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
2,2-dimethyl-5-[methyl(piperidin-3-ylmethyl)amino]pentanenitrile
CID 106636578
N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
N-methyl-N-(piperidin-3-ylmethyl)octan-1-amine
CID 106623723
3-[methyl(piperidin-3-ylmethyl)amino]propanenitrile
CID 80554591
2,2,3,3,3-pentafluoro-N-methyl-N-(piperidin-3-ylmethyl)propanamide
CID 114038062
2-cyclobutyl-N-methyl-N-(2-piperidin-3-ylethyl)ethanamine
CID 115211477
3-(2,2-dimethylpropyl)piperidine
CID 21041533
4-[methyl(piperidin-3-ylmethyl)amino]butan-2-ol
CID 115741590
N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
CID 119932323

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine?
The IUPAC name of 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine (CID 84674393) is 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine.
What is the SMILES notation for 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine?
The canonical SMILES for 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine is CN(CC1CCCNC1)CC(C)(F)F.
What is the InChIKey of 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine?
The InChIKey is GGCYCPPZWUETDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2/c1-10(11,12)8-14(2)7-9-4-3-5-13-6-9/h9,13H,3-8H2,1-2H3.
What are the key properties of 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine?
2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine has a molecular weight of 206.28 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 84674393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).