cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene

C12H24 — CID 177145950

IUPACcis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene
SMILESC=C.C[C@H]1CCC(C)(C)[C@H](C)C1
InChIInChI=1S/C10H20.C2H4/c1-8-5-6-10(3,4)9(2)7-8;1-2/h8-9H,5-7H2,1-4H3;1-2H2/t8-,9+;/m0./s1
InChIKeyWLNZNOGSHXVBCI-OULXEKPRSA-N
MW168.32 g/mol
LogP4.27
Rot. Bonds

About cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene

cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene (PubChem CID 177145950) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene.

Molecular Properties

Compound Namecis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene
PubChem CID177145950
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Namecis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene
SMILESC=C.C[C@H]1CCC(C)(C)[C@H](C)C1
InChIInChI=1S/C10H20.C2H4/c1-8-5-6-10(3,4)9(2)7-8;1-2/h8-9H,5-7H2,1-4H3;1-2H2/t8-,9+;/m0./s1
InChIKeyWLNZNOGSHXVBCI-OULXEKPRSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.27
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

(2S)-1,1,2-trimethylcyclobutane
CID 59954523
trans-(2S,4S)-1,1,2,4-tetramethylcyclopentane
CID 6427704
N,N,3,4,4-pentamethylcyclohexan-1-amine
CID 91209585
2-methoxy-1,1,4-trimethylcyclohexane
CID 70179049
4-ethyl-1,1,2-trimethylcyclohexane
CID 91194488
[(1S,2S,4R)-1,2,4-trimethylcyclohexyl]methanamine
CID 125452405
[(1S,2R,4S)-1,2,4-trimethylcyclohexyl]methanol
CID 7061819
triethyl-(3,4,4-trimethylcyclohexyl)azanium
CID 176650635
6,8-dimethylspiro[2.5]octan-2-amine
CID 64755024
1-(aminomethyl)-2,4-dimethylcyclohexan-1-amine
CID 64761739
2,2,4,7,7-pentamethylbicyclo[6.2.0]decane
CID 148883655
2,4-dimethyl-1-propylcyclohexan-1-ol
CID 64756023

Frequently Asked Questions

What is the IUPAC name of cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene?
The IUPAC name of cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene (CID 177145950) is cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene.
What is the SMILES notation for cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene?
The canonical SMILES for cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene is C=C.C[C@H]1CCC(C)(C)[C@H](C)C1.
What is the InChIKey of cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene?
The InChIKey is WLNZNOGSHXVBCI-OULXEKPRSA-N. The full InChI is InChI=1S/C10H20.C2H4/c1-8-5-6-10(3,4)9(2)7-8;1-2/h8-9H,5-7H2,1-4H3;1-2H2/t8-,9+;/m0./s1.
What are the key properties of cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene?
cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene has a molecular weight of 168.32 g/mol, XLogP of 4.27, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(2R,4S)-1,1,2,4-tetramethylcyclohexane;ethene is sourced from PubChem (CID 177145950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).