N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine

C9H17F4NO — CID 62355625

IUPACN-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
SMILESCCNCC(C)(C)OCC(F)(F)C(F)F
InChIInChI=1S/C9H17F4NO/c1-4-14-5-8(2,3)15-6-9(12,13)7(10)11/h7,14H,4-6H2,1-3H3
InChIKeyUHSBDLSNQHUCMR-UHFFFAOYSA-N
MW231.23 g/mol
LogP2.29
Rot. Bonds7

About N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine

N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine (PubChem CID 62355625) has the molecular formula C9H17F4NO and a molecular weight of 231.23 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
PubChem CID62355625
Molecular FormulaC9H17F4NO
Molecular Weight231.23 g/mol
Exact Mass231.12
IUPAC NameN-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine
SMILESCCNCC(C)(C)OCC(F)(F)C(F)F
InChIInChI=1S/C9H17F4NO/c1-4-14-5-8(2,3)15-6-9(12,13)7(10)11/h7,14H,4-6H2,1-3H3
InChIKeyUHSBDLSNQHUCMR-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

2,2-Dimethyl-6-(trifluoromethyl)morpholine
CID 65102380
2-Methyl-2-(trifluoromethyl)morpholine hydrochloride
CID 118610583
2-(Difluoromethyl)-2-methylmorpholine
CID 126794171
N-[2-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)oxyethyl]propan-2-amine
CID 57916980
2,2,2-trifluoro-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethanamine
CID 62599025
N-methyl-2-(3,3,3-trifluoropropoxy)butan-1-amine
CID 82959124
2-Methyl-2-(trifluoromethyl)morpholine
CID 84021568
2-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)oxy-N-methylethanamine
CID 89146026
2-(4,4-difluoropentoxy)-N,2-dimethylpropan-1-amine
CID 91181200
2-propan-2-yloxy-N-[2-(trifluoromethoxy)ethyl]ethanamine
CID 104760288
2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-propylpropan-1-amine
CID 118346576
2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxy-N-methylethanamine
CID 126551519

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The IUPAC name of N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine (CID 62355625) is N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine is CCNCC(C)(C)OCC(F)(F)C(F)F.
What is the InChIKey of N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
The InChIKey is UHSBDLSNQHUCMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F4NO/c1-4-14-5-8(2,3)15-6-9(12,13)7(10)11/h7,14H,4-6H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine?
N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine has a molecular weight of 231.23 g/mol, XLogP of 2.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-(2,2,3,3-tetrafluoropropoxy)propan-1-amine is sourced from PubChem (CID 62355625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).