2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane

C9H16 — CID 91265668

IUPAC2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane
SMILESCC(C)C1C2CC(C)C21
InChIInChI=1S/C9H16/c1-5(2)8-7-4-6(3)9(7)8/h5-9H,4H2,1-3H3
InChIKeyJBFBLDSDWYJOGM-UHFFFAOYSA-N
MW124.23 g/mol
LogP2.54
Rot. Bonds1

About 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane

2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane (PubChem CID 91265668) has the molecular formula C9H16 and a molecular weight of 124.23 g/mol. Its IUPAC name is 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane.

Molecular Properties

Compound Name2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane
PubChem CID91265668
Molecular FormulaC9H16
Molecular Weight124.23 g/mol
Exact Mass124.13
IUPAC Name2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane
SMILESCC(C)C1C2CC(C)C21
InChIInChI=1S/C9H16/c1-5(2)8-7-4-6(3)9(7)8/h5-9H,4H2,1-3H3
InChIKeyJBFBLDSDWYJOGM-UHFFFAOYSA-N
XLogP2.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.23
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane
CID 123539722
N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide
CID 146534371
1-cyclopropyl-2,4-dimethyl-3-propan-2-ylcyclopentane
CID 123954813
3-ethyl-2,7-dimethyl-6-propan-2-ylbicyclo[3.2.0]heptane
CID 123742163
4-methyl-2-propan-2-yltricyclo[6.1.0.03,5]nonane
CID 91310355
3,6-dimethyltricyclo[3.3.0.02,8]octane
CID 123298522
2,5-dimethylbicyclo[2.2.0]hexane
CID 91558991
3-propan-2-yltricyclo[3.1.1.12,4]octane
CID 176821598
1,3-dimethyl-2-(2-methylcyclopropyl)cyclobutane
CID 91132090
1,2-bis[2,3-bis(2,3-dicyclopropylcyclopropyl)cyclopropyl]-3-propan-2-ylcyclopropane
CID 153452162
ethane;1-methyl-2-propan-2-ylcyclopropane
CID 143332059
azane;1-methyl-2-propan-2-ylcyclopropane
CID 21258764

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane?
The IUPAC name of 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane (CID 91265668) is 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane.
What is the SMILES notation for 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane?
The canonical SMILES for 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane is CC(C)C1C2CC(C)C21.
What is the InChIKey of 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane?
The InChIKey is JBFBLDSDWYJOGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16/c1-5(2)8-7-4-6(3)9(7)8/h5-9H,4H2,1-3H3.
What are the key properties of 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane?
2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane has a molecular weight of 124.23 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane is sourced from PubChem (CID 91265668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).