1,3-dimethyl-2-propan-2-ylidenecyclopentane

C10H18 — CID 557296

IUPAC1,3-dimethyl-2-propan-2-ylidenecyclopentane
SMILESCC(C)=C1C(C)CCC1C
InChIInChI=1S/C10H18/c1-7(2)10-8(3)5-6-9(10)4/h8-9H,5-6H2,1-4H3
InChIKeyLJWZSLRJTXIWDN-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.39
Rot. Bonds

About 1,3-dimethyl-2-propan-2-ylidenecyclopentane

1,3-dimethyl-2-propan-2-ylidenecyclopentane (PubChem CID 557296) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is 1,3-dimethyl-2-propan-2-ylidenecyclopentane.

Molecular Properties

Compound Name1,3-dimethyl-2-propan-2-ylidenecyclopentane
PubChem CID557296
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name1,3-dimethyl-2-propan-2-ylidenecyclopentane
SMILESCC(C)=C1C(C)CCC1C
InChIInChI=1S/C10H18/c1-7(2)10-8(3)5-6-9(10)4/h8-9H,5-6H2,1-4H3
InChIKeyLJWZSLRJTXIWDN-UHFFFAOYSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2-propan-2-ylidenecyclopentane?
The IUPAC name of 1,3-dimethyl-2-propan-2-ylidenecyclopentane (CID 557296) is 1,3-dimethyl-2-propan-2-ylidenecyclopentane.
What is the SMILES notation for 1,3-dimethyl-2-propan-2-ylidenecyclopentane?
The canonical SMILES for 1,3-dimethyl-2-propan-2-ylidenecyclopentane is CC(C)=C1C(C)CCC1C.
What is the InChIKey of 1,3-dimethyl-2-propan-2-ylidenecyclopentane?
The InChIKey is LJWZSLRJTXIWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-7(2)10-8(3)5-6-9(10)4/h8-9H,5-6H2,1-4H3.
What are the key properties of 1,3-dimethyl-2-propan-2-ylidenecyclopentane?
1,3-dimethyl-2-propan-2-ylidenecyclopentane has a molecular weight of 138.25 g/mol, XLogP of 3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2-propan-2-ylidenecyclopentane is sourced from PubChem (CID 557296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).