ethene;1,2,3-trimethyl-4-propylcyclopentane

C13H26 — CID 162276276

IUPACethene;1,2,3-trimethyl-4-propylcyclopentane
SMILESC=C.CCCC1CC(C)C(C)C1C
InChIInChI=1S/C11H22.C2H4/c1-5-6-11-7-8(2)9(3)10(11)4;1-2/h8-11H,5-7H2,1-4H3;1-2H2
InChIKeyMQWIJDNRLNINQW-UHFFFAOYSA-N
MW182.35 g/mol
LogP4.52
Rot. Bonds2

About ethene;1,2,3-trimethyl-4-propylcyclopentane

ethene;1,2,3-trimethyl-4-propylcyclopentane (PubChem CID 162276276) has the molecular formula C13H26 and a molecular weight of 182.35 g/mol. Its IUPAC name is ethene;1,2,3-trimethyl-4-propylcyclopentane.

Molecular Properties

Compound Nameethene;1,2,3-trimethyl-4-propylcyclopentane
PubChem CID162276276
Molecular FormulaC13H26
Molecular Weight182.35 g/mol
Exact Mass182.20
IUPAC Nameethene;1,2,3-trimethyl-4-propylcyclopentane
SMILESC=C.CCCC1CC(C)C(C)C1C
InChIInChI=1S/C11H22.C2H4/c1-5-6-11-7-8(2)9(3)10(11)4;1-2/h8-11H,5-7H2,1-4H3;1-2H2
InChIKeyMQWIJDNRLNINQW-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.35
LogP ≤ 54.52
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

1-butyl-2,3,4,5-tetramethylcyclohexane
CID 167492243
1,2,4-trimethyl-5-propylcyclohexane
CID 20777497
2,6-dimethyl-4-propylbicyclo[3.1.0]hexane
CID 123147574
ethane;1-methyl-2-propylcyclopropane
CID 144710386
ethane;1,2,4-trimethyl-5-propylcyclohexane
CID 156835083
2,3,5-trimethyl-1-propylcycloheptane
CID 123381227
2-methyl-4-propylcyclobutan-1-ol
CID 91553284
acetylene;1-methyl-2-propylcyclopropane;propane
CID 173373842
2-methyl-1,3-dipropylcyclopentane
CID 90887551
2,5-dimethyl-4-propylcyclohexan-1-ol
CID 58534195
ethane;1-ethyl-2,3-dimethylcyclobutane
CID 142059191
1,4-dimethyl-2-propylcyclopentane;ethane
CID 155717345

Frequently Asked Questions

What is the IUPAC name of ethene;1,2,3-trimethyl-4-propylcyclopentane?
The IUPAC name of ethene;1,2,3-trimethyl-4-propylcyclopentane (CID 162276276) is ethene;1,2,3-trimethyl-4-propylcyclopentane.
What is the SMILES notation for ethene;1,2,3-trimethyl-4-propylcyclopentane?
The canonical SMILES for ethene;1,2,3-trimethyl-4-propylcyclopentane is C=C.CCCC1CC(C)C(C)C1C.
What is the InChIKey of ethene;1,2,3-trimethyl-4-propylcyclopentane?
The InChIKey is MQWIJDNRLNINQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.C2H4/c1-5-6-11-7-8(2)9(3)10(11)4;1-2/h8-11H,5-7H2,1-4H3;1-2H2.
What are the key properties of ethene;1,2,3-trimethyl-4-propylcyclopentane?
ethene;1,2,3-trimethyl-4-propylcyclopentane has a molecular weight of 182.35 g/mol, XLogP of 4.52, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;1,2,3-trimethyl-4-propylcyclopentane is sourced from PubChem (CID 162276276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).