methane;pentane;propane

C14H44 — CID 159978864

IUPACmethane;pentane;propane
SMILESC.C.C.C.C.C.CCC.CCCCC
InChIInChI=1S/C5H12.C3H8.6CH4/c1-3-5-4-2;1-3-2;;;;;;/h3-5H2,1-2H3;3H2,1-2H3;6*1H4
InChIKeyOFMUIXKBWDDKSY-UHFFFAOYSA-N
MW212.51 g/mol
LogP7.43
Rot. Bonds2

About methane;pentane;propane

methane;pentane;propane (PubChem CID 159978864) has the molecular formula C14H44 and a molecular weight of 212.51 g/mol. Its IUPAC name is methane;pentane;propane.

Molecular Properties

Compound Namemethane;pentane;propane
PubChem CID159978864
Molecular FormulaC14H44
Molecular Weight212.51 g/mol
Exact Mass212.34
IUPAC Namemethane;pentane;propane
SMILESC.C.C.C.C.C.CCC.CCCCC
InChIInChI=1S/C5H12.C3H8.6CH4/c1-3-5-4-2;1-3-2;;;;;;/h3-5H2,1-2H3;3H2,1-2H3;6*1H4
InChIKeyOFMUIXKBWDDKSY-UHFFFAOYSA-N
XLogP7.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.51
LogP ≤ 57.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

methane;pentane;propane
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CID 165146348
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butane;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 159978864) is methane;pentane;propane.
What is the SMILES notation for methane;pentane;propane?
The canonical SMILES for methane;pentane;propane is C.C.C.C.C.C.CCC.CCCCC.
What is the InChIKey of methane;pentane;propane?
The InChIKey is OFMUIXKBWDDKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12.C3H8.6CH4/c1-3-5-4-2;1-3-2;;;;;;/h3-5H2,1-2H3;3H2,1-2H3;6*1H4.
What are the key properties of methane;pentane;propane?
methane;pentane;propane has a molecular weight of 212.51 g/mol, XLogP of 7.43, 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 159978864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).