3-propylcyclopropene

C6H10 — CID 19958669

IUPAC3-propylcyclopropene
SMILESCCCC1C=C1
InChIInChI=1S/C6H10/c1-2-3-6-4-5-6/h4-6H,2-3H2,1H3
InChIKeyVFGSVWMWDNAQMH-UHFFFAOYSA-N
MW82.15 g/mol
LogP1.97
Rot. Bonds2

About 3-propylcyclopropene

3-propylcyclopropene (PubChem CID 19958669) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol. Its IUPAC name is 3-propylcyclopropene.

Molecular Properties

Compound Name3-propylcyclopropene
PubChem CID19958669
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name3-propylcyclopropene
SMILESCCCC1C=C1
InChIInChI=1S/C6H10/c1-2-3-6-4-5-6/h4-6H,2-3H2,1H3
InChIKeyVFGSVWMWDNAQMH-UHFFFAOYSA-N
XLogP1.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.15
LogP ≤ 51.97
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

3-methyl-6-propylcyclohexa-1,4-diene
CID 143307807
3,6-dibutylcyclohexa-1,4-diene
CID 90992302
4-propyl-1,4-dihydropyridine
CID 20549684
4-propyl-4H-azepine
CID 123929548
5-undecylcyclopenta-1,3-diene
CID 141280590
3-(3,3-dimethylpentyl)cyclopropene
CID 70378856
(1R,6R)-6-butylcycloocta-2,4,7-trien-1-ol
CID 71416520
2-[4-(2-hydroxyethyl)cyclohexa-2,5-dien-1-yl]ethanol
CID 101087121
9-propyl-4b,8a,9,9a-tetrahydro-4aH-fluorene
CID 59075885
5-propylcyclohexa-1,3-diene
CID 13212987
4-methyl-3-propylcyclopentene
CID 91050594
5-ethyl-6-propylbicyclo[2.2.1]hept-2-ene
CID 154358020

Frequently Asked Questions

What is the IUPAC name of 3-propylcyclopropene?
The IUPAC name of 3-propylcyclopropene (CID 19958669) is 3-propylcyclopropene.
What is the SMILES notation for 3-propylcyclopropene?
The canonical SMILES for 3-propylcyclopropene is CCCC1C=C1.
What is the InChIKey of 3-propylcyclopropene?
The InChIKey is VFGSVWMWDNAQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10/c1-2-3-6-4-5-6/h4-6H,2-3H2,1H3.
What are the key properties of 3-propylcyclopropene?
3-propylcyclopropene has a molecular weight of 82.15 g/mol, XLogP of 1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylcyclopropene is sourced from PubChem (CID 19958669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).