(1R)-1-methyl-3-methylidenecyclopentane

C7H12 — CID 58904772

IUPAC(1R)-1-methyl-3-methylidenecyclopentane
SMILESC=C1CC[C@@H](C)C1
InChIInChI=1S/C7H12/c1-6-3-4-7(2)5-6/h7H,1,3-5H2,2H3/t7-/m1/s1
InChIKeyBMLMXLRJGCBOOF-SSDOTTSWSA-N
MW96.17 g/mol
LogP2.36
Rot. Bonds

About (1R)-1-methyl-3-methylidenecyclopentane

(1R)-1-methyl-3-methylidenecyclopentane (PubChem CID 58904772) has the molecular formula C7H12 and a molecular weight of 96.17 g/mol. Its IUPAC name is (1R)-1-methyl-3-methylidenecyclopentane.

Molecular Properties

Compound Name(1R)-1-methyl-3-methylidenecyclopentane
PubChem CID58904772
Molecular FormulaC7H12
Molecular Weight96.17 g/mol
Exact Mass96.09
IUPAC Name(1R)-1-methyl-3-methylidenecyclopentane
SMILESC=C1CC[C@@H](C)C1
InChIInChI=1S/C7H12/c1-6-3-4-7(2)5-6/h7H,1,3-5H2,2H3/t7-/m1/s1
InChIKeyBMLMXLRJGCBOOF-SSDOTTSWSA-N
XLogP2.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.17
LogP ≤ 52.36
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 (1R)-1-methyl-3-methylidenecyclopentane?
The IUPAC name of (1R)-1-methyl-3-methylidenecyclopentane (CID 58904772) is (1R)-1-methyl-3-methylidenecyclopentane.
What is the SMILES notation for (1R)-1-methyl-3-methylidenecyclopentane?
The canonical SMILES for (1R)-1-methyl-3-methylidenecyclopentane is C=C1CC[C@@H](C)C1.
What is the InChIKey of (1R)-1-methyl-3-methylidenecyclopentane?
The InChIKey is BMLMXLRJGCBOOF-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H12/c1-6-3-4-7(2)5-6/h7H,1,3-5H2,2H3/t7-/m1/s1.
What are the key properties of (1R)-1-methyl-3-methylidenecyclopentane?
(1R)-1-methyl-3-methylidenecyclopentane has a molecular weight of 96.17 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-methyl-3-methylidenecyclopentane is sourced from PubChem (CID 58904772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).