1-methyl-3-propan-2-ylidenecyclopentene

C9H14 — CID 150029885

IUPAC1-methyl-3-propan-2-ylidenecyclopentene
SMILESCC1=CC(=C(C)C)CC1
InChIInChI=1S/C9H14/c1-7(2)9-5-4-8(3)6-9/h6H,4-5H2,1-3H3
InChIKeyDHAILULKZVRECO-UHFFFAOYSA-N
MW122.21 g/mol
LogP3.06
Rot. Bonds

About 1-methyl-3-propan-2-ylidenecyclopentene

1-methyl-3-propan-2-ylidenecyclopentene (PubChem CID 150029885) has the molecular formula C9H14 and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-methyl-3-propan-2-ylidenecyclopentene.

Molecular Properties

Compound Name1-methyl-3-propan-2-ylidenecyclopentene
PubChem CID150029885
Molecular FormulaC9H14
Molecular Weight122.21 g/mol
Exact Mass122.11
IUPAC Name1-methyl-3-propan-2-ylidenecyclopentene
SMILESCC1=CC(=C(C)C)CC1
InChIInChI=1S/C9H14/c1-7(2)9-5-4-8(3)6-9/h6H,4-5H2,1-3H3
InChIKeyDHAILULKZVRECO-UHFFFAOYSA-N
XLogP3.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
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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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-propan-2-ylidenecyclopentene?
The IUPAC name of 1-methyl-3-propan-2-ylidenecyclopentene (CID 150029885) is 1-methyl-3-propan-2-ylidenecyclopentene.
What is the SMILES notation for 1-methyl-3-propan-2-ylidenecyclopentene?
The canonical SMILES for 1-methyl-3-propan-2-ylidenecyclopentene is CC1=CC(=C(C)C)CC1.
What is the InChIKey of 1-methyl-3-propan-2-ylidenecyclopentene?
The InChIKey is DHAILULKZVRECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14/c1-7(2)9-5-4-8(3)6-9/h6H,4-5H2,1-3H3.
What are the key properties of 1-methyl-3-propan-2-ylidenecyclopentene?
1-methyl-3-propan-2-ylidenecyclopentene has a molecular weight of 122.21 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-propan-2-ylidenecyclopentene is sourced from PubChem (CID 150029885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).