N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine

C10H20F2N2 — CID 106638969

IUPACN-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine
SMILESCCN(CC(F)F)CC1CCCNC1
InChIInChI=1S/C10H20F2N2/c1-2-14(8-10(11)12)7-9-4-3-5-13-6-9/h9-10,13H,2-8H2,1H3
InChIKeySRINRAYGDVWKEQ-UHFFFAOYSA-N
MW206.28 g/mol
LogP1.57
Rot. Bonds5

About N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine

N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine (PubChem CID 106638969) has the molecular formula C10H20F2N2 and a molecular weight of 206.28 g/mol. Its IUPAC name is N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine
PubChem CID106638969
Molecular FormulaC10H20F2N2
Molecular Weight206.28 g/mol
Exact Mass206.16
IUPAC NameN-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine
SMILESCCN(CC(F)F)CC1CCCNC1
InChIInChI=1S/C10H20F2N2/c1-2-14(8-10(11)12)7-9-4-3-5-13-6-9/h9-10,13H,2-8H2,1H3
InChIKeySRINRAYGDVWKEQ-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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-[ethyl(piperidin-3-ylmethyl)amino]butan-2-ol
CID 106638403
2-[2,2-difluoroethyl(piperidin-3-ylmethyl)amino]ethanol
CID 107494945
2-cyclopentyl-N-ethyl-N-(piperidin-3-ylmethyl)ethanamine
CID 114191629
N-[(4-fluorophenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624468
N-[(4-ethylphenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624684
N-ethyl-3-ethylsulfonyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 106638991
N-ethyl-4-methylsulfanyl-N-(piperidin-3-ylmethyl)butan-1-amine
CID 106624526
N-ethyl-2-(4-methylpiperazin-1-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 106638421
N-[(5-chloro-2-fluorophenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624365
N-(piperidin-3-ylmethyl)-N-[(2,4,6-trimethylphenyl)methyl]ethanamine
CID 106624469
N-ethyl-N-(piperidin-3-ylmethyl)heptan-4-amine
CID 106624422
N-[(2,3-difluorophenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624705

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine?
The IUPAC name of N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine (CID 106638969) is N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine?
The canonical SMILES for N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine is CCN(CC(F)F)CC1CCCNC1.
What is the InChIKey of N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine?
The InChIKey is SRINRAYGDVWKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2/c1-2-14(8-10(11)12)7-9-4-3-5-13-6-9/h9-10,13H,2-8H2,1H3.
What are the key properties of N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine?
N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine has a molecular weight of 206.28 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-difluoro-N-(piperidin-3-ylmethyl)ethanamine is sourced from PubChem (CID 106638969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).