N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine

C11H23F2NO — CID 164933170

IUPACN-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)COC(F)(F)CNC(C)(C)C
InChIInChI=1S/C11H23F2NO/c1-9(2,3)8-15-11(12,13)7-14-10(4,5)6/h14H,7-8H2,1-6H3
InChIKeyAOUHGEHPVAHIEU-UHFFFAOYSA-N
MW223.31 g/mol
LogP3.03
Rot. Bonds4

About N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine

N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine (PubChem CID 164933170) has the molecular formula C11H23F2NO and a molecular weight of 223.31 g/mol. Its IUPAC name is N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine
PubChem CID164933170
Molecular FormulaC11H23F2NO
Molecular Weight223.31 g/mol
Exact Mass223.17
IUPAC NameN-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)COC(F)(F)CNC(C)(C)C
InChIInChI=1S/C11H23F2NO/c1-9(2,3)8-15-11(12,13)7-14-10(4,5)6/h14H,7-8H2,1-6H3
InChIKeyAOUHGEHPVAHIEU-UHFFFAOYSA-N
XLogP3.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.31
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,3-trimethyl-N-[2-(trifluoromethoxy)ethyl]butan-2-amine
CID 58297123
N-[2-(2,2,2-trifluoroethoxy)ethyl]propan-2-amine
CID 61492430
N-[2-(2,2-difluoroethoxy)ethyl]propan-2-amine
CID 62342201
2,2,2-trifluoro-N-(2-propoxyethyl)ethanamine
CID 62582651
2,2,2-trifluoro-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethanamine
CID 62599025
2-methyl-N-[2-(trifluoromethoxy)ethyl]propan-2-amine
CID 65804944
2,3-dimethyl-N-[2-(trifluoromethoxy)ethyl]butan-2-amine
CID 88934659
3-methyl-N-(2,2,2-trifluoroethyl)oxetan-3-amine
CID 123703720
N-tert-butyl-4-[2-(tert-butylamino)ethoxy]-3,3-difluorobutan-1-amine
CID 138460818
N-[2-[2-[2-(tert-butylamino)-2,2-difluoroethoxy]-2,2-difluoroethoxy]-2,2-difluoroethyl]-2-methylpropan-2-amine
CID 138467557
2-methyl-N-[2-(trifluoromethoxy)ethyl]butan-2-amine;molecular hydrogen
CID 144110107
1-(difluoromethoxy)-N-ethyl-2-methylpropan-2-amine
CID 146476432

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine (CID 164933170) is N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine is CC(C)(C)COC(F)(F)CNC(C)(C)C.
What is the InChIKey of N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine?
The InChIKey is AOUHGEHPVAHIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23F2NO/c1-9(2,3)8-15-11(12,13)7-14-10(4,5)6/h14H,7-8H2,1-6H3.
What are the key properties of N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine?
N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine has a molecular weight of 223.31 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-dimethylpropoxy)-2,2-difluoroethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 164933170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).