1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine

C10H15F6NO — CID 102722000

IUPAC1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine
SMILESCCNC(COC(C(F)(F)F)C(F)(F)F)C1CC1
InChIInChI=1S/C10H15F6NO/c1-2-17-7(6-3-4-6)5-18-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3
InChIKeyRLNOGQHIHCIQOD-UHFFFAOYSA-N
MW279.22 g/mol
LogP2.88
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine

1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine (PubChem CID 102722000) has the molecular formula C10H15F6NO and a molecular weight of 279.22 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine
PubChem CID102722000
Molecular FormulaC10H15F6NO
Molecular Weight279.22 g/mol
Exact Mass279.11
IUPAC Name1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine
SMILESCCNC(COC(C(F)(F)F)C(F)(F)F)C1CC1
InChIInChI=1S/C10H15F6NO/c1-2-17-7(6-3-4-6)5-18-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3
InChIKeyRLNOGQHIHCIQOD-UHFFFAOYSA-N
XLogP2.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-N-ethyl-2-propan-2-yloxyethanamine
CID 79574827
N-ethyl-1-(4-ethylcyclohexyl)-2-propan-2-yloxyethanamine
CID 79575007
1-cyclopentyl-N-ethyl-4,4,4-trifluorobutan-1-amine
CID 64565156
(1R)-1-cyclopropyl-N-ethyl-2,2,2-trifluoroethanamine
CID 166734030
N-ethyl-2-propan-2-yloxy-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 105168105
1-(4-tert-butylcyclohexyl)-2-ethoxy-N-ethylethanamine
CID 79574193
1-cyclopropyl-N-ethyl-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 62600415
1-cycloheptyl-N-ethyl-2-methoxyethanamine
CID 79574660
1-cyclopropyl-2-(4,4-dimethylcyclohexyl)oxy-N-ethylethanamine
CID 114340882
1-(4,4-difluorocyclohexyl)-N-ethyl-2-methoxyethanamine
CID 105165589
2-(2-tert-butylphenoxy)-1-cyclopropyl-N-ethylethanamine
CID 63912498
1-(4,4-difluorocyclohexyl)-2-ethoxy-N-ethylethanamine
CID 105165065

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine?
The IUPAC name of 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine (CID 102722000) is 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine is CCNC(COC(C(F)(F)F)C(F)(F)F)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine?
The InChIKey is RLNOGQHIHCIQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F6NO/c1-2-17-7(6-3-4-6)5-18-8(9(11,12)13)10(14,15)16/h6-8,17H,2-5H2,1H3.
What are the key properties of 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine?
1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine has a molecular weight of 279.22 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)ethanamine is sourced from PubChem (CID 102722000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).