3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene

C14H24 — CID 91062996

IUPAC3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene
SMILESCCCC1=C(C2(CCC)CC2)C1CC
InChIInChI=1S/C14H24/c1-4-7-12-11(6-3)13(12)14(8-5-2)9-10-14/h11H,4-10H2,1-3H3
InChIKeyDQGYBBTWOSEJKA-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.70
Rot. Bonds6

About 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene

3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene (PubChem CID 91062996) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene.

Molecular Properties

Compound Name3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene
PubChem CID91062996
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene
SMILESCCCC1=C(C2(CCC)CC2)C1CC
InChIInChI=1S/C14H24/c1-4-7-12-11(6-3)13(12)14(8-5-2)9-10-14/h11H,4-10H2,1-3H3
InChIKeyDQGYBBTWOSEJKA-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.70
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

Bicyclogermacrene
CID 13894537
(2Z,6Z)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
CID 21159022
(+)-Bicyclogermacrene
CID 5315347
(1S,2E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
CID 44583886
trans-Bicyclogermacradiene
CID 11820258
Isobicyclogermacrene
CID 16055278
(1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo(8.1.0)undeca-2,6-diene
CID 13894533
Isolepidozene
CID 13894538
cis-Bicyclogermacradiene
CID 91747210
CID 522276
CID 522276
(1S,2Z,6E,10S)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
CID 13894536
(1S,2E,6E,10R)-2,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene
CID 15764614

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene?
The IUPAC name of 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene (CID 91062996) is 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene.
What is the SMILES notation for 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene?
The canonical SMILES for 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene is CCCC1=C(C2(CCC)CC2)C1CC.
What is the InChIKey of 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene?
The InChIKey is DQGYBBTWOSEJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-4-7-12-11(6-3)13(12)14(8-5-2)9-10-14/h11H,4-10H2,1-3H3.
What are the key properties of 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene?
3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene has a molecular weight of 192.35 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-propyl-2-(1-propylcyclopropyl)cyclopropene is sourced from PubChem (CID 91062996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).