1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene

C10H14 — CID 19033295

IUPAC1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene
SMILESCC(C)=C1C=CC(C)=C1C
InChIInChI=1S/C10H14/c1-7(2)10-6-5-8(3)9(10)4/h5-6H,1-4H3
InChIKeyWKRHQTOGLHUTSR-UHFFFAOYSA-N
MW134.22 g/mol
LogP3.23
Rot. Bonds

About 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene

1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene (PubChem CID 19033295) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene
PubChem CID19033295
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene
SMILESCC(C)=C1C=CC(C)=C1C
InChIInChI=1S/C10H14/c1-7(2)10-6-5-8(3)9(10)4/h5-6H,1-4H3
InChIKeyWKRHQTOGLHUTSR-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

trans-Alloocimene
CID 5368821
Farnesene
CID 5281516
beta-Ocimene
CID 18756
beta-Ocimene, (3Z)-
CID 5320250
beta-OCIMENE, (3E)-
CID 5281553
2,6-Dimethylocta-2,4,6-triene
CID 12658
2,4-Hexadiene, 3-methyl-
CID 5367612
1,3-Pentadiene, 2-methyl-
CID 14238
1-Methyl-1,3-cyclopentadiene
CID 66775
2-Methyl-1,3-cyclohexadiene
CID 73885
(Z,E)-alpha-Farnesene
CID 5362889
(3E)-4,8-dimethyl-1,3,7-nonatriene
CID 6427110

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene?
The IUPAC name of 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene (CID 19033295) is 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene.
What is the SMILES notation for 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene?
The canonical SMILES for 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene is CC(C)=C1C=CC(C)=C1C.
What is the InChIKey of 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene?
The InChIKey is WKRHQTOGLHUTSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-7(2)10-6-5-8(3)9(10)4/h5-6H,1-4H3.
What are the key properties of 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene?
1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene has a molecular weight of 134.22 g/mol, XLogP of 3.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5-propan-2-ylidenecyclopenta-1,3-diene is sourced from PubChem (CID 19033295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).