2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene

C10H16 — CID 91344176

IUPAC2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene
SMILESCCCC1=C2C(C)C(C)C12
InChIInChI=1S/C10H16/c1-4-5-8-9-6(2)7(3)10(8)9/h6-7,9H,4-5H2,1-3H3
InChIKeyFOXMZTUIHBSTIW-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.00
Rot. Bonds2

About 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene

2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene (PubChem CID 91344176) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene.

Molecular Properties

Compound Name2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene
PubChem CID91344176
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene
SMILESCCCC1=C2C(C)C(C)C12
InChIInChI=1S/C10H16/c1-4-5-8-9-6(2)7(3)10(8)9/h6-7,9H,4-5H2,1-3H3
InChIKeyFOXMZTUIHBSTIW-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.00
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

(3S,4S)-3,4-dimethyl-1,2-dipropylcyclopentene
CID 101214135
1,3-dimethyl-2-propylcyclopentene
CID 143544281
2,3,4,5-tetrapropylcyclopent-3-en-1-one
CID 12027231
iron;bis(1,2,3,5-tetramethyl-4-propylcyclopenta-1,3-diene)
CID 22465099
(1S,3S,4S,6R)-3,4-dimethyltricyclo[4.2.1.02,5]non-2(5)-ene
CID 101249321
4-butyl-2-methyl-5-propyl-2,3-dihydro-1H-imidazole
CID 142423599
(2,3,4,5-tetrapropylcyclopenta-1,3-dien-1-yl)germane;titanium;dihydrochloride
CID 173327563
(3R,5S)-1,2,3,4,5-pentamethylcyclopentene;(5S)-1,2,3,4,5-pentamethylcyclopentene;propane
CID 91251322
2,3-dipropylcyclobuten-1-ol
CID 174995483
(5,6-dimethyl-2-propylcyclohexa-2,4-dien-1-yl)phosphane
CID 143728382
bis(1,4-dimethylcyclohexane);methane;propane
CID 159253657
1-[(1R,3R)-3-methylcyclopentyl]oxy-4-propylbenzene
CID 178142508

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene?
The IUPAC name of 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene (CID 91344176) is 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene.
What is the SMILES notation for 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene?
The canonical SMILES for 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene is CCCC1=C2C(C)C(C)C12.
What is the InChIKey of 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene?
The InChIKey is FOXMZTUIHBSTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-4-5-8-9-6(2)7(3)10(8)9/h6-7,9H,4-5H2,1-3H3.
What are the key properties of 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene?
2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene has a molecular weight of 136.24 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-propylbicyclo[2.1.0]pent-1(5)-ene is sourced from PubChem (CID 91344176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).