(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine

C10H20F3N — CID 166869584

IUPAC(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine
SMILESCC[C@H](CC(C)(C)C(F)(F)F)N(C)C
InChIInChI=1S/C10H20F3N/c1-6-8(14(4)5)7-9(2,3)10(11,12)13/h8H,6-7H2,1-5H3/t8-/m1/s1
InChIKeyGVCCYPRTTLGVMV-MRVPVSSYSA-N
MW211.27 g/mol
LogP3.31
Rot. Bonds4

About (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine

(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine (PubChem CID 166869584) has the molecular formula C10H20F3N and a molecular weight of 211.27 g/mol. Its IUPAC name is (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine.

Molecular Properties

Compound Name(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine
PubChem CID166869584
Molecular FormulaC10H20F3N
Molecular Weight211.27 g/mol
Exact Mass211.15
IUPAC Name(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine
SMILESCC[C@H](CC(C)(C)C(F)(F)F)N(C)C
InChIInChI=1S/C10H20F3N/c1-6-8(14(4)5)7-9(2,3)10(11,12)13/h8H,6-7H2,1-5H3/t8-/m1/s1
InChIKeyGVCCYPRTTLGVMV-MRVPVSSYSA-N
XLogP3.31
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine?
The IUPAC name of (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine (CID 166869584) is (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine.
What is the SMILES notation for (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine?
The canonical SMILES for (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine is CC[C@H](CC(C)(C)C(F)(F)F)N(C)C.
What is the InChIKey of (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine?
The InChIKey is GVCCYPRTTLGVMV-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H20F3N/c1-6-8(14(4)5)7-9(2,3)10(11,12)13/h8H,6-7H2,1-5H3/t8-/m1/s1.
What are the key properties of (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine?
(3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine has a molecular weight of 211.27 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6,6,6-trifluoro-N,N,5,5-tetramethylhexan-3-amine is sourced from PubChem (CID 166869584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).