3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]

C19H18 — CID 10890210

IUPAC3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]
SMILESC=C1CC2(CC1C)c1ccccc1-c1ccccc12
InChIInChI=1S/C19H18/c1-13-11-19(12-14(13)2)17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14H,1,11-12H2,2H3
InChIKeyDSUFIANBXQMFOZ-UHFFFAOYSA-N
MW246.35 g/mol
LogP4.94
Rot. Bonds

About 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]

3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene] (PubChem CID 10890210) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene].

Molecular Properties

Compound Name3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]
PubChem CID10890210
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]
SMILESC=C1CC2(CC1C)c1ccccc1-c1ccccc12
InChIInChI=1S/C19H18/c1-13-11-19(12-14(13)2)17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14H,1,11-12H2,2H3
InChIKeyDSUFIANBXQMFOZ-UHFFFAOYSA-N
XLogP4.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 54.94
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 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]?
The IUPAC name of 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene] (CID 10890210) is 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene].
What is the SMILES notation for 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]?
The canonical SMILES for 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene] is C=C1CC2(CC1C)c1ccccc1-c1ccccc12.
What is the InChIKey of 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]?
The InChIKey is DSUFIANBXQMFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-13-11-19(12-14(13)2)17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14H,1,11-12H2,2H3.
What are the key properties of 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene]?
3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene] has a molecular weight of 246.35 g/mol, XLogP of 4.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-methylidenespiro[cyclopentane-1,9'-fluorene] is sourced from PubChem (CID 10890210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).