[(2R)-but-3-en-2-yl]cyclohexane

C10H18 — CID 11007980

IUPAC[(2R)-but-3-en-2-yl]cyclohexane
SMILESC=C[C@@H](C)C1CCCCC1
InChIInChI=1S/C10H18/c1-3-9(2)10-7-5-4-6-8-10/h3,9-10H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyVNBGVYNPGOMPHX-SECBINFHSA-N
MW138.25 g/mol
LogP3.39
Rot. Bonds2

About [(2R)-but-3-en-2-yl]cyclohexane

[(2R)-but-3-en-2-yl]cyclohexane (PubChem CID 11007980) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is [(2R)-but-3-en-2-yl]cyclohexane.

Molecular Properties

Compound Name[(2R)-but-3-en-2-yl]cyclohexane
PubChem CID11007980
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name[(2R)-but-3-en-2-yl]cyclohexane
SMILESC=C[C@@H](C)C1CCCCC1
InChIInChI=1S/C10H18/c1-3-9(2)10-7-5-4-6-8-10/h3,9-10H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyVNBGVYNPGOMPHX-SECBINFHSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
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 [(2R)-but-3-en-2-yl]cyclohexane?
The IUPAC name of [(2R)-but-3-en-2-yl]cyclohexane (CID 11007980) is [(2R)-but-3-en-2-yl]cyclohexane.
What is the SMILES notation for [(2R)-but-3-en-2-yl]cyclohexane?
The canonical SMILES for [(2R)-but-3-en-2-yl]cyclohexane is C=C[C@@H](C)C1CCCCC1.
What is the InChIKey of [(2R)-but-3-en-2-yl]cyclohexane?
The InChIKey is VNBGVYNPGOMPHX-SECBINFHSA-N. The full InChI is InChI=1S/C10H18/c1-3-9(2)10-7-5-4-6-8-10/h3,9-10H,1,4-8H2,2H3/t9-/m1/s1.
What are the key properties of [(2R)-but-3-en-2-yl]cyclohexane?
[(2R)-but-3-en-2-yl]cyclohexane has a molecular weight of 138.25 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-but-3-en-2-yl]cyclohexane is sourced from PubChem (CID 11007980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).