3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine

C8H17F2NO2 — CID 165466401

IUPAC3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine
SMILESCCOCC(C)OCC(F)(F)CN
InChIInChI=1S/C8H17F2NO2/c1-3-12-4-7(2)13-6-8(9,10)5-11/h7H,3-6,11H2,1-2H3
InChIKeyOYRXIDOODSTVPY-UHFFFAOYSA-N
MW197.22 g/mol
LogP1.02
Rot. Bonds7

About 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine

3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine (PubChem CID 165466401) has the molecular formula C8H17F2NO2 and a molecular weight of 197.22 g/mol. Its IUPAC name is 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine.

Molecular Properties

Compound Name3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine
PubChem CID165466401
Molecular FormulaC8H17F2NO2
Molecular Weight197.22 g/mol
Exact Mass197.12
IUPAC Name3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine
SMILESCCOCC(C)OCC(F)(F)CN
InChIInChI=1S/C8H17F2NO2/c1-3-12-4-7(2)13-6-8(9,10)5-11/h7H,3-6,11H2,1-2H3
InChIKeyOYRXIDOODSTVPY-UHFFFAOYSA-N
XLogP1.02
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-difluoro-3-(4-methylpentan-2-yloxy)propan-1-amine
CID 165466400
(2R)-1,2-diethoxypropane
CID 92973991
2-amino-3-(1-ethoxypropan-2-yloxy)-2-methylpropanenitrile
CID 103489757
ethyl 3-(1-ethoxypropan-2-yloxy)-2-methyl-2-(methylamino)propanoate
CID 103489778
2-ethoxy-1-(2-ethoxypropoxy)propane
CID 21277912
3-(1-ethoxypropan-2-yloxy)-2-methylpropane-1-sulfonamide
CID 103491006
2-(1-ethoxypropan-2-yloxy)ethanethiol
CID 103491367
2-(2-chloroethoxy)-1-ethoxypropane
CID 103487889
3-(1-ethoxypropan-2-yloxy)-2-(ethylamino)-2-methylpropanoic acid
CID 103489783
3-ethoxy-1,1,1-trifluoropropan-2-amine
CID 64981755
1-ethoxy-2-(2-ethoxypropoxy)propane;1-ethoxy-2-(2-methoxypropoxy)propane
CID 159210596
2-amino-4-(1-ethoxypropan-2-yloxy)-2-methylbutan-1-ol
CID 103491080

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine?
The IUPAC name of 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine (CID 165466401) is 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine.
What is the SMILES notation for 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine?
The canonical SMILES for 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine is CCOCC(C)OCC(F)(F)CN.
What is the InChIKey of 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine?
The InChIKey is OYRXIDOODSTVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F2NO2/c1-3-12-4-7(2)13-6-8(9,10)5-11/h7H,3-6,11H2,1-2H3.
What are the key properties of 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine?
3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine has a molecular weight of 197.22 g/mol, XLogP of 1.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxypropan-2-yloxy)-2,2-difluoropropan-1-amine is sourced from PubChem (CID 165466401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).