(3R)-1,2-dimethyl-3-propylcyclohexene

C11H20 — CID 143703597

IUPAC(3R)-1,2-dimethyl-3-propylcyclohexene
SMILESCCC[C@@H]1CCCC(C)=C1C
InChIInChI=1S/C11H20/c1-4-6-11-8-5-7-9(2)10(11)3/h11H,4-8H2,1-3H3/t11-/m1/s1
InChIKeyJNXQLQRHYVYAPA-LLVKDONJSA-N
MW152.28 g/mol
LogP3.92
Rot. Bonds2

About (3R)-1,2-dimethyl-3-propylcyclohexene

(3R)-1,2-dimethyl-3-propylcyclohexene (PubChem CID 143703597) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is (3R)-1,2-dimethyl-3-propylcyclohexene.

Molecular Properties

Compound Name(3R)-1,2-dimethyl-3-propylcyclohexene
PubChem CID143703597
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name(3R)-1,2-dimethyl-3-propylcyclohexene
SMILESCCC[C@@H]1CCCC(C)=C1C
InChIInChI=1S/C11H20/c1-4-6-11-8-5-7-9(2)10(11)3/h11H,4-8H2,1-3H3/t11-/m1/s1
InChIKeyJNXQLQRHYVYAPA-LLVKDONJSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.92
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 (3R)-1,2-dimethyl-3-propylcyclohexene?
The IUPAC name of (3R)-1,2-dimethyl-3-propylcyclohexene (CID 143703597) is (3R)-1,2-dimethyl-3-propylcyclohexene.
What is the SMILES notation for (3R)-1,2-dimethyl-3-propylcyclohexene?
The canonical SMILES for (3R)-1,2-dimethyl-3-propylcyclohexene is CCC[C@@H]1CCCC(C)=C1C.
What is the InChIKey of (3R)-1,2-dimethyl-3-propylcyclohexene?
The InChIKey is JNXQLQRHYVYAPA-LLVKDONJSA-N. The full InChI is InChI=1S/C11H20/c1-4-6-11-8-5-7-9(2)10(11)3/h11H,4-8H2,1-3H3/t11-/m1/s1.
What are the key properties of (3R)-1,2-dimethyl-3-propylcyclohexene?
(3R)-1,2-dimethyl-3-propylcyclohexene has a molecular weight of 152.28 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1,2-dimethyl-3-propylcyclohexene is sourced from PubChem (CID 143703597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).