7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane

C17H24 — CID 123237786

IUPAC7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane
SMILESC=C1CC12CC21CC12CC21CC1(C)C(C)CC
InChIInChI=1S/C17H24/c1-5-11(2)13(4)7-15(13)9-17(15)10-16(17)8-14(16)6-12(14)3/h11H,3,5-10H2,1-2,4H3
InChIKeyYMQSEGQZXIIVPY-UHFFFAOYSA-N
MW228.38 g/mol
LogP4.56
Rot. Bonds2

About 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane

7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane (PubChem CID 123237786) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane.

Molecular Properties

Compound Name7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane
PubChem CID123237786
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Name7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane
SMILESC=C1CC12CC21CC12CC21CC1(C)C(C)CC
InChIInChI=1S/C17H24/c1-5-11(2)13(4)7-15(13)9-17(15)10-16(17)8-14(16)6-12(14)3/h11H,3,5-10H2,1-2,4H3
InChIKeyYMQSEGQZXIIVPY-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane with MolForge

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Related Compounds

1,1-Dimethyl-2-(2-methyl-2-propenyl)cyclopropane
CID 534976
1-Pentene, 5-(2,2-dimethylcyclopropyl)-2-methyl-4-methylene-
CID 535149
1,5-Dimethyl-6-methylenespiro(2.4)heptane
CID 556472
1-(4-Tert-butyl-5-methylhexa-1,5-dien-2-yl)-1-fluorocyclopropane
CID 169620909
Cyclopropane, 1-(1-methylethyl)-2-(2-methyl-1-methylenepropyl)-
CID 557213
1-(1-Methylcyclopropyl)-2-methylidenecyclopropane
CID 15208287
1-Cyclopropyl-1-methyl-2-methylidenecyclopropane
CID 123638266
1-cyclopropyl-1-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclopropane
CID 140742695
8-Methylidene-2-prop-1-en-2-ylspiro[2.5]octane
CID 12435167
4-Methylidene-1-(prop-1-en-2-yl)spiro[2.6]nonane
CID 12435173
6-Methylidenetrispiro[2.0.0.25.14.13]nonane
CID 14787802
7-Methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane
CID 14787805

Frequently Asked Questions

What is the IUPAC name of 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane?
The IUPAC name of 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane (CID 123237786) is 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane.
What is the SMILES notation for 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane?
The canonical SMILES for 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane is C=C1CC12CC21CC12CC21CC1(C)C(C)CC.
What is the InChIKey of 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane?
The InChIKey is YMQSEGQZXIIVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24/c1-5-11(2)13(4)7-15(13)9-17(15)10-16(17)8-14(16)6-12(14)3/h11H,3,5-10H2,1-2,4H3.
What are the key properties of 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane?
7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane has a molecular weight of 228.38 g/mol, XLogP of 4.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-butan-2-yl-7-methyl-2-methylidenetetraspiro[2.0.0.0.26.15.14.13]undecane is sourced from PubChem (CID 123237786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).