1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane

C11H18 — CID 123510406

IUPAC1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane
SMILESC=C1C(C)C2(CC)CC12CC
InChIInChI=1S/C11H18/c1-5-10-7-11(10,6-2)9(4)8(10)3/h9H,3,5-7H2,1-2,4H3
InChIKeyDMOOSNSSQHEUDL-UHFFFAOYSA-N
MW150.27 g/mol
LogP3.39
Rot. Bonds2

About 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane

1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane (PubChem CID 123510406) has the molecular formula C11H18 and a molecular weight of 150.27 g/mol. Its IUPAC name is 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane.

Molecular Properties

Compound Name1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane
PubChem CID123510406
Molecular FormulaC11H18
Molecular Weight150.27 g/mol
Exact Mass150.14
IUPAC Name1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane
SMILESC=C1C(C)C2(CC)CC12CC
InChIInChI=1S/C11H18/c1-5-10-7-11(10,6-2)9(4)8(10)3/h9H,3,5-7H2,1-2,4H3
InChIKeyDMOOSNSSQHEUDL-UHFFFAOYSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.27
LogP ≤ 53.39
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-ethyl-2-methyl-3-propylbicyclo[1.1.0]butane
CID 123467509
1,5-dimethyl-2-methylidenespiro[2.2]pentane
CID 123800289
1-ethyl-2,3,3,4,5-pentamethylbicyclo[3.1.0]hexane
CID 123592730
(1S,2S,6R)-1-ethyl-1,2,6-trimethyl-3-methylidenecyclohexane
CID 157314245
4-ethyl-3,4,5-trimethyl-2-methylidenecyclohexan-1-amine
CID 143547151
1,2-dimethyl-4-methylidenebicyclo[1.1.1]pentane
CID 123498475
1-(1-ethyl-2,2,3-trimethyl-4-methylidenecyclopentyl)ethenol
CID 143539259
trans-(2S,4R)-4-ethyl-1,1,2,4-tetramethylcyclopentane
CID 163416827
ethane;1-ethyl-N,N,3-trimethylcyclobutan-1-amine
CID 169125880
2-ethyl-4,6-dimethyltricyclo[2.2.0.02,6]hexane
CID 123830649
(1-methyl-4-methylidenecyclohexyl)methylphosphane
CID 161459122
1-ethyl-1-(1-ethyl-2-methylcyclopropyl)cyclobutane
CID 123436733

Frequently Asked Questions

What is the IUPAC name of 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane?
The IUPAC name of 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane (CID 123510406) is 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane.
What is the SMILES notation for 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane?
The canonical SMILES for 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane is C=C1C(C)C2(CC)CC12CC.
What is the InChIKey of 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane?
The InChIKey is DMOOSNSSQHEUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-5-10-7-11(10,6-2)9(4)8(10)3/h9H,3,5-7H2,1-2,4H3.
What are the key properties of 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane?
1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane has a molecular weight of 150.27 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethyl-2-methyl-3-methylidenebicyclo[2.1.0]pentane is sourced from PubChem (CID 123510406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).