1-(2-methylpent-1-enyl)cyclopropene

C9H14 — CID 123481940

IUPAC1-(2-methylpent-1-enyl)cyclopropene
SMILESCCCC(C)=CC1=CC1
InChIInChI=1S/C9H14/c1-3-4-8(2)7-9-5-6-9/h5,7H,3-4,6H2,1-2H3
InChIKeyQWCFEPJODSZGCS-UHFFFAOYSA-N
MW122.21 g/mol
LogP3.06
Rot. Bonds3

About 1-(2-methylpent-1-enyl)cyclopropene

1-(2-methylpent-1-enyl)cyclopropene (PubChem CID 123481940) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-(2-methylpent-1-enyl)cyclopropene.

Molecular Properties

Compound Name1-(2-methylpent-1-enyl)cyclopropene
PubChem CID123481940
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-(2-methylpent-1-enyl)cyclopropene
SMILESCCCC(C)=CC1=CC1
InChIInChI=1S/C9H14/c1-3-4-8(2)7-9-5-6-9/h5,7H,3-4,6H2,1-2H3
InChIKeyQWCFEPJODSZGCS-UHFFFAOYSA-N
XLogP3.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

N-[(E)-2-methylpent-1-enyl]methanimine
CID 142044769
1-chloro-3-[(E)-2-methylpent-1-enyl]benzene
CID 174941626
1-iodo-2-methylpent-1-ene
CID 73232688
2-methyl-1-(2-methylpent-1-enyldisulfanyl)pent-1-ene
CID 175555923
3-methylhex-2-enylidenecyclobutane
CID 123804515
1-(2-methylpent-1-enyl)-2-nitrobenzene
CID 158113954
4-methylhexadec-4-ene
CID 174447790
(4E)-2,3,5-trimethylocta-2,4-diene
CID 144603275
actinium;bis(3-methylhex-2-en-1-ol)
CID 160943648
(5E,9Z)-6,10,14-trimethylheptadeca-5,9,13-trien-2-one
CID 162428625
1-(3-methylpent-2-enyl)cyclopropene
CID 123369820
2-methyl-1-(2-methylpent-1-enylsulfonyl)pent-1-ene
CID 57106864

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpent-1-enyl)cyclopropene?
The IUPAC name of 1-(2-methylpent-1-enyl)cyclopropene (CID 123481940) is 1-(2-methylpent-1-enyl)cyclopropene.
What is the SMILES notation for 1-(2-methylpent-1-enyl)cyclopropene?
The canonical SMILES for 1-(2-methylpent-1-enyl)cyclopropene is CCCC(C)=CC1=CC1.
What is the InChIKey of 1-(2-methylpent-1-enyl)cyclopropene?
The InChIKey is QWCFEPJODSZGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-3-4-8(2)7-9-5-6-9/h5,7H,3-4,6H2,1-2H3.
What are the key properties of 1-(2-methylpent-1-enyl)cyclopropene?
1-(2-methylpent-1-enyl)cyclopropene has a molecular weight of 122.21 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpent-1-enyl)cyclopropene is sourced from PubChem (CID 123481940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).