(3R)-2-methyl-3-(trifluoromethyl)pentane

C7H13F3 — CID 87152925

IUPAC(3R)-2-methyl-3-(trifluoromethyl)pentane
SMILESCC[C@H](C(C)C)C(F)(F)F
InChIInChI=1S/C7H13F3/c1-4-6(5(2)3)7(8,9)10/h5-6H,4H2,1-3H3/t6-/m1/s1
InChIKeyJZRQDWNZAQPMSR-ZCFIWIBFSA-N
MW154.17 g/mol
LogP3.23
Rot. Bonds2

About (3R)-2-methyl-3-(trifluoromethyl)pentane

(3R)-2-methyl-3-(trifluoromethyl)pentane (PubChem CID 87152925) has the molecular formula C7H13F3 and a molecular weight of 154.17 g/mol. Its IUPAC name is (3R)-2-methyl-3-(trifluoromethyl)pentane.

Molecular Properties

Compound Name(3R)-2-methyl-3-(trifluoromethyl)pentane
PubChem CID87152925
Molecular FormulaC7H13F3
Molecular Weight154.17 g/mol
Exact Mass154.10
IUPAC Name(3R)-2-methyl-3-(trifluoromethyl)pentane
SMILESCC[C@H](C(C)C)C(F)(F)F
InChIInChI=1S/C7H13F3/c1-4-6(5(2)3)7(8,9)10/h5-6H,4H2,1-3H3/t6-/m1/s1
InChIKeyJZRQDWNZAQPMSR-ZCFIWIBFSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3R)-2-methyl-3-(trifluoromethyl)pentane?
The IUPAC name of (3R)-2-methyl-3-(trifluoromethyl)pentane (CID 87152925) is (3R)-2-methyl-3-(trifluoromethyl)pentane.
What is the SMILES notation for (3R)-2-methyl-3-(trifluoromethyl)pentane?
The canonical SMILES for (3R)-2-methyl-3-(trifluoromethyl)pentane is CC[C@H](C(C)C)C(F)(F)F.
What is the InChIKey of (3R)-2-methyl-3-(trifluoromethyl)pentane?
The InChIKey is JZRQDWNZAQPMSR-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H13F3/c1-4-6(5(2)3)7(8,9)10/h5-6H,4H2,1-3H3/t6-/m1/s1.
What are the key properties of (3R)-2-methyl-3-(trifluoromethyl)pentane?
(3R)-2-methyl-3-(trifluoromethyl)pentane has a molecular weight of 154.17 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2-methyl-3-(trifluoromethyl)pentane is sourced from PubChem (CID 87152925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).