ethene;pentylcyclopentane

C12H24 — CID 145442606

IUPACethene;pentylcyclopentane
SMILESC=C.CCCCCC1CCCC1
InChIInChI=1S/C10H20.C2H4/c1-2-3-4-7-10-8-5-6-9-10;1-2/h10H,2-9H2,1H3;1-2H2
InChIKeyMGILHMFHEGWSCT-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.56
Rot. Bonds4

About ethene;pentylcyclopentane

ethene;pentylcyclopentane (PubChem CID 145442606) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is ethene;pentylcyclopentane.

Molecular Properties

Compound Nameethene;pentylcyclopentane
PubChem CID145442606
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Nameethene;pentylcyclopentane
SMILESC=C.CCCCCC1CCCC1
InChIInChI=1S/C10H20.C2H4/c1-2-3-4-7-10-8-5-6-9-10;1-2/h10H,2-9H2,1H3;1-2H2
InChIKeyMGILHMFHEGWSCT-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tetradecylcycloundecane
CID 169026040
docosylcyclohexane
CID 521991
octylcyclotetradecane
CID 175261841
tetradecylcyclododecane
CID 169026037
azane;heptylcyclohexane
CID 121434222
hexane;pentylcyclopropane
CID 159592467
carbanide;dichlorozirconium(2+);bis(heptylcyclopentane)
CID 162290746
1-butyl-4-(2-cyclopentylethyl)cyclohexane
CID 157379859
octadecane;pentadecylcyclopropane
CID 173301851
1,4-dihexylcyclohexane
CID 22947938
tetradecane;undecylcyclopropane
CID 173215670
1-dodecyl-4-pentadecylcyclohexane
CID 123560684

Frequently Asked Questions

What is the IUPAC name of ethene;pentylcyclopentane?
The IUPAC name of ethene;pentylcyclopentane (CID 145442606) is ethene;pentylcyclopentane.
What is the SMILES notation for ethene;pentylcyclopentane?
The canonical SMILES for ethene;pentylcyclopentane is C=C.CCCCCC1CCCC1.
What is the InChIKey of ethene;pentylcyclopentane?
The InChIKey is MGILHMFHEGWSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C2H4/c1-2-3-4-7-10-8-5-6-9-10;1-2/h10H,2-9H2,1H3;1-2H2.
What are the key properties of ethene;pentylcyclopentane?
ethene;pentylcyclopentane has a molecular weight of 168.32 g/mol, XLogP of 4.56, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;pentylcyclopentane is sourced from PubChem (CID 145442606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).