1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine

C9H3F18N — CID 165176683

IUPAC1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine
SMILESFC(F)(F)C(N(C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C9H3F18N/c10-4(11,12)1(5(13,14)15)28(2(6(16,17)18)7(19,20)21)3(8(22,23)24)9(25,26)27/h1-3H
InChIKeyUEQDIXMOCQURFJ-UHFFFAOYSA-N
MW467.09 g/mol
LogP5.77
Rot. Bonds3

About 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine

1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine (PubChem CID 165176683) has the molecular formula C9H3F18N and a molecular weight of 467.09 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine.

Molecular Properties

Compound Name1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine
PubChem CID165176683
Molecular FormulaC9H3F18N
Molecular Weight467.09 g/mol
Exact Mass467.00
IUPAC Name1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine
SMILESFC(F)(F)C(N(C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C9H3F18N/c10-4(11,12)1(5(13,14)15)28(2(6(16,17)18)7(19,20)21)3(8(22,23)24)9(25,26)27/h1-3H
InChIKeyUEQDIXMOCQURFJ-UHFFFAOYSA-N
XLogP5.77
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.09
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

lithium;boric acid;1,1,1,3,3,3-hexafluoropropan-2-olate
CID 158113014
1,1,1,2,2-pentafluoroethane iodide
CID 157061199
N,N,1,1,2,3,3-heptafluoropropan-2-amine
CID 19390373
N,N-diethyl-1,2,3,3,3-pentafluoropropan-1-amine
CID 5092161
1,1,1-trifluorobutane-2,3-diamine
CID 130988807
1,1,1,4,4,4-hexafluoro-2,3-diiodobutane
CID 139684738
ethane;1,1,1-trifluoro-2-methylpropane
CID 155727070
1,2,2,2-tetrafluoroethanethiol
CID 57068914
(2S,3S)-2,3-dibromo-1,1,1,4,4,4-hexafluorobutane
CID 97291901
1,1,1,3,3,3-hexafluoro-2-methylpropane
CID 158463707
1,2,2,2-tetrafluoroethyl-λ2-stannane
CID 174539767
magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride
CID 175390788

Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine?
The IUPAC name of 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine (CID 165176683) is 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine.
What is the SMILES notation for 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine?
The canonical SMILES for 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine is FC(F)(F)C(N(C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine?
The InChIKey is UEQDIXMOCQURFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H3F18N/c10-4(11,12)1(5(13,14)15)28(2(6(16,17)18)7(19,20)21)3(8(22,23)24)9(25,26)27/h1-3H.
What are the key properties of 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine?
1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine has a molecular weight of 467.09 g/mol, XLogP of 5.77, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3,3,3-hexafluoro-N,N-bis(1,1,1,3,3,3-hexafluoropropan-2-yl)propan-2-amine is sourced from PubChem (CID 165176683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).