methane;pentane;propane

C12H32 — CID 143342797

IUPACmethane;pentane;propane
SMILESC.CCC.CCC.CCCCC
InChIInChI=1S/C5H12.2C3H8.CH4/c1-3-5-4-2;2*1-3-2;/h3-5H2,1-2H3;2*3H2,1-2H3;1H4
InChIKeyXBFSKWXZCHNYDF-UHFFFAOYSA-N
MW176.39 g/mol
LogP5.67
Rot. Bonds2

About methane;pentane;propane

methane;pentane;propane (PubChem CID 143342797) has the molecular formula C12H32 and a molecular weight of 176.39 g/mol. Its IUPAC name is methane;pentane;propane.

Molecular Properties

Compound Namemethane;pentane;propane
PubChem CID143342797
Molecular FormulaC12H32
Molecular Weight176.39 g/mol
Exact Mass176.25
IUPAC Namemethane;pentane;propane
SMILESC.CCC.CCC.CCCCC
InChIInChI=1S/C5H12.2C3H8.CH4/c1-3-5-4-2;2*1-3-2;/h3-5H2,1-2H3;2*3H2,1-2H3;1H4
InChIKeyXBFSKWXZCHNYDF-UHFFFAOYSA-N
XLogP5.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500176.39
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

methane;pentane;propane
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Frequently Asked Questions

What is the IUPAC name of methane;pentane;propane?
The IUPAC name of methane;pentane;propane (CID 143342797) is methane;pentane;propane.
What is the SMILES notation for methane;pentane;propane?
The canonical SMILES for methane;pentane;propane is C.CCC.CCC.CCCCC.
What is the InChIKey of methane;pentane;propane?
The InChIKey is XBFSKWXZCHNYDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12.2C3H8.CH4/c1-3-5-4-2;2*1-3-2;/h3-5H2,1-2H3;2*3H2,1-2H3;1H4.
What are the key properties of methane;pentane;propane?
methane;pentane;propane has a molecular weight of 176.39 g/mol, XLogP of 5.67, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;pentane;propane is sourced from PubChem (CID 143342797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).