trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane

C11H20 — CID 6850748

IUPACtrans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane
SMILESC=C1CC[C@@H](C(C)C)C[C@H]1C
InChIInChI=1S/C11H20/c1-8(2)11-6-5-9(3)10(4)7-11/h8,10-11H,3,5-7H2,1-2,4H3/t10-,11-/m1/s1
InChIKeyWKAIZQNXCIXEBZ-GHMZBOCLSA-N
MW152.28 g/mol
LogP3.63
Rot. Bonds1

About trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane

trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane (PubChem CID 6850748) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane.

Molecular Properties

Compound Nametrans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane
PubChem CID6850748
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Nametrans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane
SMILESC=C1CC[C@@H](C(C)C)C[C@H]1C
InChIInChI=1S/C11H20/c1-8(2)11-6-5-9(3)10(4)7-11/h8,10-11H,3,5-7H2,1-2,4H3/t10-,11-/m1/s1
InChIKeyWKAIZQNXCIXEBZ-GHMZBOCLSA-N
XLogP3.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methylidene-5-propan-2-ylcyclohexan-1-ol
CID 12642437
3-methyl-4-methylidenecyclohexan-1-ol
CID 91313026
1-methyl-2-methylidenecyclobutane
CID 20800914
(5R)-2-methylidene-5-propan-2-ylcyclohexan-1-ol;(4R)-1-methyl-4-propan-2-yl-7-oxabicyclo[4.1.0]heptane
CID 157385514
(3S,4aR,8aS)-8a-methyl-5-methylidene-3-propan-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
CID 162873957
(2R,4R)-2-methyl-4-propan-2-ylpiperidine
CID 96733113
4-fluoro-1-methylidene-2-propan-2-ylcyclohexane
CID 123303828
(3R)-1-methyl-3-propan-2-ylcyclohexane
CID 154523132
cis-(1S,3R)-1-methyl-3-propan-2-ylcyclopentane;ethane;hydrofluoride
CID 169140803
propan-2-ylcyclopropane;hydroiodide
CID 162314014
trans-(1R,4R)-2-methylidene-4-propan-2-ylcyclohexan-1-ol
CID 156807995
(5R,7R)-4,10-dimethylidene-7-propan-2-ylspiro[4.5]decane
CID 11138213

Frequently Asked Questions

What is the IUPAC name of trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane?
The IUPAC name of trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane (CID 6850748) is trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane.
What is the SMILES notation for trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane?
The canonical SMILES for trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane is C=C1CC[C@@H](C(C)C)C[C@H]1C.
What is the InChIKey of trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane?
The InChIKey is WKAIZQNXCIXEBZ-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H20/c1-8(2)11-6-5-9(3)10(4)7-11/h8,10-11H,3,5-7H2,1-2,4H3/t10-,11-/m1/s1.
What are the key properties of trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane?
trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane has a molecular weight of 152.28 g/mol, XLogP of 3.63, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane is sourced from PubChem (CID 6850748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).