1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane

C15H30 — CID 91279351

IUPAC1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane
SMILESCC(C)C1CC(C(C)C)C1(C)C(C)(C)C
InChIInChI=1S/C15H30/c1-10(2)12-9-13(11(3)4)15(12,8)14(5,6)7/h10-13H,9H2,1-8H3
InChIKeyFZZOYMQYXLAUGV-UHFFFAOYSA-N
MW210.40 g/mol
LogP4.99
Rot. Bonds2

About 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane

1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane (PubChem CID 91279351) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane.

Molecular Properties

Compound Name1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane
PubChem CID91279351
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane
SMILESCC(C)C1CC(C(C)C)C1(C)C(C)(C)C
InChIInChI=1S/C15H30/c1-10(2)12-9-13(11(3)4)15(12,8)14(5,6)7/h10-13H,9H2,1-8H3
InChIKeyFZZOYMQYXLAUGV-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.40
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-tert-butyl-1,1,2-trimethyl-3-propan-2-ylcyclobutane
CID 123668668
(2S)-2-ethyl-1,1-dimethyl-4-propan-2-ylcyclobutane
CID 162292361
2-ethyl-1,1-dimethyl-4-propan-2-ylcyclobutane
CID 91239546
1,1-dimethyl-2-propan-2-ylcyclopentane
CID 23384810
(2,2-dimethyl-3-propan-2-ylcyclobutyl)methanol
CID 175095277
1,1,3,3-tetramethyl-2-propan-2-ylcyclobutane
CID 123542682
1-ethyl-1-methyl-2-propan-2-ylcyclopropane
CID 91445155
1-cyclopropyl-1-methyl-2-propan-2-ylcyclopropane
CID 123698843
(1R,6S)-1-methyl-6-propan-2-ylcyclohex-3-en-1-ol
CID 129013708
ethane;1-fluoro-1,5-dimethyl-2-propan-2-ylcyclohexane
CID 171106643
1-but-1-ynyl-1-methyl-2-propan-2-ylcyclopropane
CID 123938589
cis-(1R,2R)-1-methyl-2-propan-2-ylcyclopentan-1-ol
CID 158874958

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane?
The IUPAC name of 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane (CID 91279351) is 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane.
What is the SMILES notation for 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane?
The canonical SMILES for 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane is CC(C)C1CC(C(C)C)C1(C)C(C)(C)C.
What is the InChIKey of 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane?
The InChIKey is FZZOYMQYXLAUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-10(2)12-9-13(11(3)4)15(12,8)14(5,6)7/h10-13H,9H2,1-8H3.
What are the key properties of 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane?
1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane has a molecular weight of 210.40 g/mol, XLogP of 4.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-1-methyl-2,4-di(propan-2-yl)cyclobutane is sourced from PubChem (CID 91279351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).