(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane

C15H24 — CID 102318015

IUPAC(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane
SMILESC=C1CC[C@]2([C@@]3(C)CCCC3(C)C)C[C@H]12
InChIInChI=1S/C15H24/c1-11-6-9-15(10-12(11)15)14(4)8-5-7-13(14,2)3/h12H,1,5-10H2,2-4H3/t12-,14+,15+/m1/s1
InChIKeyYMPBLULPBSVQLP-SNPRPXQTSA-N
MW204.36 g/mol
LogP4.56
Rot. Bonds1

About (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane

(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane (PubChem CID 102318015) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane.

Molecular Properties

Compound Name(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane
PubChem CID102318015
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane
SMILESC=C1CC[C@]2([C@@]3(C)CCCC3(C)C)C[C@H]12
InChIInChI=1S/C15H24/c1-11-6-9-15(10-12(11)15)14(4)8-5-7-13(14,2)3/h12H,1,5-10H2,2-4H3/t12-,14+,15+/m1/s1
InChIKeyYMPBLULPBSVQLP-SNPRPXQTSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.56
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 (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane?
The IUPAC name of (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane (CID 102318015) is (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane.
What is the SMILES notation for (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane?
The canonical SMILES for (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane is C=C1CC[C@]2([C@@]3(C)CCCC3(C)C)C[C@H]12.
What is the InChIKey of (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane?
The InChIKey is YMPBLULPBSVQLP-SNPRPXQTSA-N. The full InChI is InChI=1S/C15H24/c1-11-6-9-15(10-12(11)15)14(4)8-5-7-13(14,2)3/h12H,1,5-10H2,2-4H3/t12-,14+,15+/m1/s1.
What are the key properties of (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane?
(1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane has a molecular weight of 204.36 g/mol, XLogP of 4.56, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R)-4-methylidene-1-[(1S)-1,2,2-trimethylcyclopentyl]bicyclo[3.1.0]hexane is sourced from PubChem (CID 102318015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).