5,8-dimethylspiro[3.4]octane;propane

C13H26 — CID 90899958

IUPAC5,8-dimethylspiro[3.4]octane;propane
SMILESCC1CCC(C)C12CCC2.CCC
InChIInChI=1S/C10H18.C3H8/c1-8-4-5-9(2)10(8)6-3-7-10;1-3-2/h8-9H,3-7H2,1-2H3;3H2,1-2H3
InChIKeyLANNGKZPIAWFCH-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.64
Rot. Bonds

About 5,8-dimethylspiro[3.4]octane;propane

5,8-dimethylspiro[3.4]octane;propane (PubChem CID 90899958) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is 5,8-dimethylspiro[3.4]octane;propane.

Molecular Properties

Compound Name5,8-dimethylspiro[3.4]octane;propane
PubChem CID90899958
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Name5,8-dimethylspiro[3.4]octane;propane
SMILESCC1CCC(C)C12CCC2.CCC
InChIInChI=1S/C10H18.C3H8/c1-8-4-5-9(2)10(8)6-3-7-10;1-3-2/h8-9H,3-7H2,1-2H3;3H2,1-2H3
InChIKeyLANNGKZPIAWFCH-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(3-methyl-1,2,3,4,5,6,7,7a-octahydroinden-3a-yl)methanamine
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1-(1-ethoxy-2-methylcyclohexyl)-N-methylmethanamine
CID 165490208
11-methylspiro[5.5]undecan-5-amine
CID 138665061
2-(bromomethyl)-8-methylspiro[2.5]octane
CID 81351055
propane;spiro[3.3]heptane
CID 176988732
1,1-dimethylcyclobutane;1,1-dimethylcyclopropane;ethane;N-methylmethanamine;propane
CID 159269502
1,2-dimethylspiro[2.4]heptane
CID 58548907
2-methylspiro[2.4]heptan-7-amine
CID 146817135
(9R)-9-methylspiro[3.5]nonane
CID 140885739
N-[(8-methylspiro[2.5]octan-2-yl)methyl]cyclopropanamine
CID 62712621
1,2-dimethylcyclohexane;ethane;propane
CID 142115318
ethane;methylcyclopentane;propane
CID 142080084

Frequently Asked Questions

What is the IUPAC name of 5,8-dimethylspiro[3.4]octane;propane?
The IUPAC name of 5,8-dimethylspiro[3.4]octane;propane (CID 90899958) is 5,8-dimethylspiro[3.4]octane;propane.
What is the SMILES notation for 5,8-dimethylspiro[3.4]octane;propane?
The canonical SMILES for 5,8-dimethylspiro[3.4]octane;propane is CC1CCC(C)C12CCC2.CCC.
What is the InChIKey of 5,8-dimethylspiro[3.4]octane;propane?
The InChIKey is LANNGKZPIAWFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18.C3H8/c1-8-4-5-9(2)10(8)6-3-7-10;1-3-2/h8-9H,3-7H2,1-2H3;3H2,1-2H3.
What are the key properties of 5,8-dimethylspiro[3.4]octane;propane?
5,8-dimethylspiro[3.4]octane;propane has a molecular weight of 182.35 g/mol, XLogP of 4.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethylspiro[3.4]octane;propane is sourced from PubChem (CID 90899958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).