3-fluoro-2-methylpentane

C6H13F — CID 23234145

IUPAC3-fluoro-2-methylpentane
SMILESCCC(F)C(C)C
InChIInChI=1S/C6H13F/c1-4-6(7)5(2)3/h5-6H,4H2,1-3H3
InChIKeyFKWMYLMQLAIXKB-UHFFFAOYSA-N
MW104.17 g/mol
LogP2.39
Rot. Bonds2

About 3-fluoro-2-methylpentane

3-fluoro-2-methylpentane (PubChem CID 23234145) has the molecular formula C6H13F and a molecular weight of 104.17 g/mol. Its IUPAC name is 3-fluoro-2-methylpentane.

Molecular Properties

Compound Name3-fluoro-2-methylpentane
PubChem CID23234145
Molecular FormulaC6H13F
Molecular Weight104.17 g/mol
Exact Mass104.10
IUPAC Name3-fluoro-2-methylpentane
SMILESCCC(F)C(C)C
InChIInChI=1S/C6H13F/c1-4-6(7)5(2)3/h5-6H,4H2,1-3H3
InChIKeyFKWMYLMQLAIXKB-UHFFFAOYSA-N
XLogP2.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.17
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-fluoro-2-methylpentane;methane
CID 158695521
4-fluoro-2-methylhexan-3-amine
CID 155312274
(3R,6S)-3-fluoro-4,6-dimethyloctane
CID 134189007
3-chloro-4-fluorohexane
CID 12545925
1,1-difluoropropane;ethane;2-methylbutane
CID 176705110
3-ethyl-2-fluoropentane
CID 144624740
(3R)-3-(fluoromethyl)-2-methylpentane
CID 88580229
(2R,3S)-1,2-difluoro-3,4-dimethylpentane
CID 174248486
(2Z)-2-ethylidene-3,4-difluorohexan-1-amine
CID 166651478
2-methylbutane
CID 159175971
(2R)-2-fluoro-3-methylbutane;(2S)-2-fluoro-3-methylbutane
CID 159156264
2-methylbutane
CID 158117812

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-methylpentane?
The IUPAC name of 3-fluoro-2-methylpentane (CID 23234145) is 3-fluoro-2-methylpentane.
What is the SMILES notation for 3-fluoro-2-methylpentane?
The canonical SMILES for 3-fluoro-2-methylpentane is CCC(F)C(C)C.
What is the InChIKey of 3-fluoro-2-methylpentane?
The InChIKey is FKWMYLMQLAIXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F/c1-4-6(7)5(2)3/h5-6H,4H2,1-3H3.
What are the key properties of 3-fluoro-2-methylpentane?
3-fluoro-2-methylpentane has a molecular weight of 104.17 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-methylpentane is sourced from PubChem (CID 23234145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).