2,2-dimethylspiro[2.2]pentane

C7H12 — CID 12950125

IUPAC2,2-dimethylspiro[2.2]pentane
SMILESCC1(C)CC12CC2
InChIInChI=1S/C7H12/c1-6(2)5-7(6)3-4-7/h3-5H2,1-2H3
InChIKeyZDGDZJPVDNRGMM-UHFFFAOYSA-N
MW96.17 g/mol
LogP2.20
Rot. Bonds

About 2,2-dimethylspiro[2.2]pentane

2,2-dimethylspiro[2.2]pentane (PubChem CID 12950125) has the molecular formula C7H12 and a molecular weight of 96.17 g/mol. Its IUPAC name is 2,2-dimethylspiro[2.2]pentane.

Molecular Properties

Compound Name2,2-dimethylspiro[2.2]pentane
PubChem CID12950125
Molecular FormulaC7H12
Molecular Weight96.17 g/mol
Exact Mass96.09
IUPAC Name2,2-dimethylspiro[2.2]pentane
SMILESCC1(C)CC12CC2
InChIInChI=1S/C7H12/c1-6(2)5-7(6)3-4-7/h3-5H2,1-2H3
InChIKeyZDGDZJPVDNRGMM-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.17
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1'-Bicyclopropyl, 1,1'-dimethyl-
CID 143588
2-Ethyl-1,1-dimethylcyclopropane
CID 142551
Dispiro(2.0.2.1)heptane
CID 141788
Trispiro(2.0.2.0.2.0)nonane
CID 141640
1-Methyl-1-propyl-cyclopropane
CID 524645
1-Methyl-1,1'-bi(cyclopropane)
CID 12950123
1-Fluoro-1-(1-methylcyclopropyl)cyclopropane
CID 11788283
1,2,2-Trimethylbicyclo[1,1,0]butane
CID 12611192
Methylspiropentane
CID 22670016
Tetramethylspiropentane
CID 129678501
1-Fluoro-2-(1-methylcyclopropyl)cyclopropane
CID 57210489
2-(Fluoromethyl)-2-methylspiro[2.2]pentane
CID 126550417

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylspiro[2.2]pentane?
The IUPAC name of 2,2-dimethylspiro[2.2]pentane (CID 12950125) is 2,2-dimethylspiro[2.2]pentane.
What is the SMILES notation for 2,2-dimethylspiro[2.2]pentane?
The canonical SMILES for 2,2-dimethylspiro[2.2]pentane is CC1(C)CC12CC2.
What is the InChIKey of 2,2-dimethylspiro[2.2]pentane?
The InChIKey is ZDGDZJPVDNRGMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12/c1-6(2)5-7(6)3-4-7/h3-5H2,1-2H3.
What are the key properties of 2,2-dimethylspiro[2.2]pentane?
2,2-dimethylspiro[2.2]pentane has a molecular weight of 96.17 g/mol, XLogP of 2.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylspiro[2.2]pentane is sourced from PubChem (CID 12950125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).