(4E)-1,3-dimethyl-4-propylidenecyclopentene

C10H16 — CID 22236779

IUPAC(4E)-1,3-dimethyl-4-propylidenecyclopentene
SMILESCC/C=C1\CC(C)=CC1C
InChIInChI=1S/C10H16/c1-4-5-10-7-8(2)6-9(10)3/h5-6,9H,4,7H2,1-3H3/b10-5+
InChIKeyJMKWTTIXFWZCIR-BJMVGYQFSA-N
MW136.24 g/mol
LogP3.31
Rot. Bonds1

About (4E)-1,3-dimethyl-4-propylidenecyclopentene

(4E)-1,3-dimethyl-4-propylidenecyclopentene (PubChem CID 22236779) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is (4E)-1,3-dimethyl-4-propylidenecyclopentene.

Molecular Properties

Compound Name(4E)-1,3-dimethyl-4-propylidenecyclopentene
PubChem CID22236779
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name(4E)-1,3-dimethyl-4-propylidenecyclopentene
SMILESCC/C=C1\CC(C)=CC1C
InChIInChI=1S/C10H16/c1-4-5-10-7-8(2)6-9(10)3/h5-6,9H,4,7H2,1-3H3/b10-5+
InChIKeyJMKWTTIXFWZCIR-BJMVGYQFSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.31
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

1,3-di(propylidene)cyclobutane
CID 123878518
(3R,4S)-3-ethyl-1,4-dimethylcyclopentene
CID 163464724
(6E)-3-methyl-6-propylidenecyclohexene-1-carbaldehyde
CID 10442023
(3R,6E)-3-methyl-6-propylidenecyclohexene-1-carbaldehyde
CID 101236983
(3Z)-1-methyl-3-propylidenecyclopentane
CID 144536317
1-pent-1-en-2-yl-2-propylidenecyclopropane
CID 123453172
3-ethyl-1,5-dimethylcyclohexene
CID 123667989
1-ethyl-3,5-dimethylcyclopenta-1,3-diene
CID 91803964
2-ethyl-4-methyl-2,5-dihydro-1H-pyrrole
CID 129143971
5,6-di(propylidene)bicyclo[2.2.1]hept-2-ene
CID 141101625
(4E)-4-propylidenecyclohexane-1,2-diol
CID 68778200
(3S)-1,3-dimethylcyclobutene
CID 58737300

Frequently Asked Questions

What is the IUPAC name of (4E)-1,3-dimethyl-4-propylidenecyclopentene?
The IUPAC name of (4E)-1,3-dimethyl-4-propylidenecyclopentene (CID 22236779) is (4E)-1,3-dimethyl-4-propylidenecyclopentene.
What is the SMILES notation for (4E)-1,3-dimethyl-4-propylidenecyclopentene?
The canonical SMILES for (4E)-1,3-dimethyl-4-propylidenecyclopentene is CC/C=C1\CC(C)=CC1C.
What is the InChIKey of (4E)-1,3-dimethyl-4-propylidenecyclopentene?
The InChIKey is JMKWTTIXFWZCIR-BJMVGYQFSA-N. The full InChI is InChI=1S/C10H16/c1-4-5-10-7-8(2)6-9(10)3/h5-6,9H,4,7H2,1-3H3/b10-5+.
What are the key properties of (4E)-1,3-dimethyl-4-propylidenecyclopentene?
(4E)-1,3-dimethyl-4-propylidenecyclopentene has a molecular weight of 136.24 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-1,3-dimethyl-4-propylidenecyclopentene is sourced from PubChem (CID 22236779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).