2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine

C11H22FNO — CID 83032755

IUPAC2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine
SMILESCCC1(CC)CC(NCCF)CCO1
InChIInChI=1S/C11H22FNO/c1-3-11(4-2)9-10(5-8-14-11)13-7-6-12/h10,13H,3-9H2,1-2H3
InChIKeyCIMZLORRMYRDNZ-UHFFFAOYSA-N
MW203.30 g/mol
LogP2.28
Rot. Bonds5

About 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine

2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine (PubChem CID 83032755) has the molecular formula C11H22FNO and a molecular weight of 203.30 g/mol. Its IUPAC name is 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine.

Molecular Properties

Compound Name2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine
PubChem CID83032755
Molecular FormulaC11H22FNO
Molecular Weight203.30 g/mol
Exact Mass203.17
IUPAC Name2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine
SMILESCCC1(CC)CC(NCCF)CCO1
InChIInChI=1S/C11H22FNO/c1-3-11(4-2)9-10(5-8-14-11)13-7-6-12/h10,13H,3-9H2,1-2H3
InChIKeyCIMZLORRMYRDNZ-UHFFFAOYSA-N
XLogP2.28
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.30
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(Tert-butoxy)ethyl]piperidine
CID 10797616
1-Oxa-9-azaspiro[5.5]undecane
CID 22975593
N,2,2-trimethyltetrahydro-2H-pyran-4-amine
CID 13764667
N-ethyl-2,2-dimethyloxan-4-amine
CID 45791211
N-ethyl-2,2-dimethyloxan-4-amine hydrochloride
CID 119031587
2-Ethyl-2-methyloxan-4-amine hydrochloride
CID 167726170
4,4-Difluoro-1-oxa-9-azaspiro[5.5]undecane
CID 155894212
4,4-Difluoro-1-oxa-9-azaspiro[5.5]undecane hydrochloride
CID 168435194
4-Fluoro-1-oxa-9-azaspiro[5.5]undecane
CID 146273106
N-[(3R)-3-fluorobutan-2-yl]-2-methyl-1-(oxan-4-yl)propan-1-amine
CID 173964280
N,2,2-trimethyloxan-4-aminehydrochloride
CID 141410410
2-ethyl-2-methyl-N-[4-(trifluoromethyl)cyclohexyl]oxan-4-amine
CID 64100730

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine?
The IUPAC name of 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine (CID 83032755) is 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine.
What is the SMILES notation for 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine?
The canonical SMILES for 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine is CCC1(CC)CC(NCCF)CCO1.
What is the InChIKey of 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine?
The InChIKey is CIMZLORRMYRDNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FNO/c1-3-11(4-2)9-10(5-8-14-11)13-7-6-12/h10,13H,3-9H2,1-2H3.
What are the key properties of 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine?
2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine has a molecular weight of 203.30 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-(2-fluoroethyl)oxan-4-amine is sourced from PubChem (CID 83032755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).