3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]

C14H22 — CID 556715

IUPAC3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]
SMILESC=C1CCC2(C1)C1CCCCCCC12
InChIInChI=1S/C14H22/c1-11-8-9-14(10-11)12-6-4-2-3-5-7-13(12)14/h12-13H,1-10H2
InChIKeyFQQDMQYDSMWOPU-UHFFFAOYSA-N
MW190.33 g/mol
LogP4.31
Rot. Bonds

About 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]

3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] (PubChem CID 556715) has the molecular formula C14H22 and a molecular weight of 190.33 g/mol. Its IUPAC name is 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane].

Molecular Properties

Compound Name3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]
PubChem CID556715
Molecular FormulaC14H22
Molecular Weight190.33 g/mol
Exact Mass190.17
IUPAC Name3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]
SMILESC=C1CCC2(C1)C1CCCCCCC12
InChIInChI=1S/C14H22/c1-11-8-9-14(10-11)12-6-4-2-3-5-7-13(12)14/h12-13H,1-10H2
InChIKeyFQQDMQYDSMWOPU-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.33
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] with MolForge

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Related Compounds

1,5-Dimethyl-6-methylenespiro(2.4)heptane
CID 556472
(1S,8R)-9-methylidenebicyclo[6.1.0]nonane
CID 11768638
9-Methylidenebicyclo[6.1.0]nonane
CID 12695813
7-Methylidene-2-prop-1-en-2-ylspiro[2.4]heptane
CID 85931635
Methylidenebicyclo[6.1.0]nonane
CID 129815821
2-Methyl-6-methylidenespiro[2.4]heptane
CID 90977402
4-Methylidenebicyclo[6.1.0]nonane
CID 123181736
2-Prop-1-en-2-ylspiro[2.4]heptane
CID 123281537
2,7-Dimethyl-2-prop-1-en-2-ylspiro[2.4]heptane
CID 123651222
2,5-Dimethyl-7-methylidenespiro[2.4]heptane
CID 123726670
1,3,3-Trimethyl-2-(2-methylprop-1-enylidene)bicyclo[6.1.0]nonane
CID 154302645
1-(Cyclopentylmethyl)-8-methylidenebicyclo[9.1.0]dodecane
CID 163580684

Frequently Asked Questions

What is the IUPAC name of 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]?
The IUPAC name of 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] (CID 556715) is 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane].
What is the SMILES notation for 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]?
The canonical SMILES for 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] is C=C1CCC2(C1)C1CCCCCCC12.
What is the InChIKey of 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]?
The InChIKey is FQQDMQYDSMWOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22/c1-11-8-9-14(10-11)12-6-4-2-3-5-7-13(12)14/h12-13H,1-10H2.
What are the key properties of 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane]?
3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] has a molecular weight of 190.33 g/mol, XLogP of 4.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-methylidenespiro[bicyclo[6.1.0]nonane-9,1'-cyclopentane] is sourced from PubChem (CID 556715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).