butane;cyclobutane;ethane;propane

C13H32 — CID 144515884

IUPACbutane;cyclobutane;ethane;propane
SMILESC1CCC1.CC.CCC.CCCC
InChIInChI=1S/C4H8.C4H10.C3H8.C2H6/c1-2-4-3-1;1-3-4-2;1-3-2;1-2/h1-4H2;3-4H2,1-2H3;3H2,1-2H3;1-2H3
InChIKeyJKQJDPMKQFCSGP-UHFFFAOYSA-N
MW188.40 g/mol
LogP5.81
Rot. Bonds1

About butane;cyclobutane;ethane;propane

butane;cyclobutane;ethane;propane (PubChem CID 144515884) has the molecular formula C13H32 and a molecular weight of 188.40 g/mol. Its IUPAC name is butane;cyclobutane;ethane;propane.

Molecular Properties

Compound Namebutane;cyclobutane;ethane;propane
PubChem CID144515884
Molecular FormulaC13H32
Molecular Weight188.40 g/mol
Exact Mass188.25
IUPAC Namebutane;cyclobutane;ethane;propane
SMILESC1CCC1.CC.CCC.CCCC
InChIInChI=1S/C4H8.C4H10.C3H8.C2H6/c1-2-4-3-1;1-3-4-2;1-3-2;1-2/h1-4H2;3-4H2,1-2H3;3H2,1-2H3;1-2H3
InChIKeyJKQJDPMKQFCSGP-UHFFFAOYSA-N
XLogP5.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500188.40
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

butane;cyclopropane;ethane
CID 143412650
cyclobutane;ethane;propane
CID 142065255
butane;cyclobutane
CID 162002820
bis(cyclohexane);ethane;propane
CID 91197261
bis(cyclohexane);ethane;propane
CID 160925836
cycloheptane;ethane;propane
CID 142095328
tris(cyclohexane);ethane;propane
CID 161084167
cyclohexane;ethane;methane;propane
CID 161168070
butane;cyclopentane;cyclopropane;2-methylpropane;propane
CID 173325576
cyclobutane;ethane;hexane;propane
CID 142383161
cyclopropane;methane;propane
CID 162181556
cyclopentane;ethane;pentane
CID 143543629

Frequently Asked Questions

What is the IUPAC name of butane;cyclobutane;ethane;propane?
The IUPAC name of butane;cyclobutane;ethane;propane (CID 144515884) is butane;cyclobutane;ethane;propane.
What is the SMILES notation for butane;cyclobutane;ethane;propane?
The canonical SMILES for butane;cyclobutane;ethane;propane is C1CCC1.CC.CCC.CCCC.
What is the InChIKey of butane;cyclobutane;ethane;propane?
The InChIKey is JKQJDPMKQFCSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.C4H10.C3H8.C2H6/c1-2-4-3-1;1-3-4-2;1-3-2;1-2/h1-4H2;3-4H2,1-2H3;3H2,1-2H3;1-2H3.
What are the key properties of butane;cyclobutane;ethane;propane?
butane;cyclobutane;ethane;propane has a molecular weight of 188.40 g/mol, XLogP of 5.81, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;cyclobutane;ethane;propane is sourced from PubChem (CID 144515884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).