(4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene

C11H16 — CID 24848565

IUPAC(4R)-1-methyl-6-methylidene-4-prop-1-en-2-ylcyclohexene
SMILESCC1=CC[C@H](CC1=C)C(=C)C
InChIInChI=1S/C11H16/c1-8(2)11-6-5-9(3)10(4)7-11/h5,11H,1,4,6-7H2,2-3H3/t11-/m1/s1
InChIKeyHXPDHZZJERCWPC-LLVKDONJSA-N
MW148.24 g/mol
LogP3.20
Rot. Bonds1

About (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene

(4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene (PubChem CID 24848565) has the molecular formula C11H16 and a molecular weight of 148.24 g/mol. Its IUPAC name is (4R)-1-methyl-6-methylidene-4-prop-1-en-2-ylcyclohexene.

Molecular Properties

Compound Name(4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene
PubChem CID24848565
Molecular FormulaC11H16
Molecular Weight148.24 g/mol
Exact Mass148.13
IUPAC Name(4R)-1-methyl-6-methylidene-4-prop-1-en-2-ylcyclohexene
SMILESCC1=CC[C@H](CC1=C)C(=C)C
InChIInChI=1S/C11H16/c1-8(2)11-6-5-9(3)10(4)7-11/h5,11H,1,4,6-7H2,2-3H3/t11-/m1/s1
InChIKeyHXPDHZZJERCWPC-LLVKDONJSA-N
XLogP3.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity218

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.24
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-4-Prop-1-En-2-Ylcyclohexene
CID 22311
(+)-Limonene
CID 440917
Limonene, (-)-
CID 439250
alpha-PHELLANDRENE
CID 7460
Gamma-Terpinene
CID 7461
Alpha-Terpinene
CID 7462
Beta-Phellandrene
CID 11142
alpha-PHELLANDRENE, (-)-
CID 442482
Beta-Bisabolene
CID 10104370
Germacrene D
CID 5317570
(+)-alpha-Phellandrene
CID 443160
Cyclohexene, 4-methyl-1-(1-methylethyl)-
CID 10369

Frequently Asked Questions

What is the IUPAC name of (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene?
The IUPAC name of (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene (CID 24848565) is (4R)-1-methyl-6-methylidene-4-prop-1-en-2-ylcyclohexene.
What is the SMILES notation for (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene?
The canonical SMILES for (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene is CC1=CC[C@H](CC1=C)C(=C)C.
What is the InChIKey of (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene?
The InChIKey is HXPDHZZJERCWPC-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16/c1-8(2)11-6-5-9(3)10(4)7-11/h5,11H,1,4,6-7H2,2-3H3/t11-/m1/s1.
What are the key properties of (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene?
(4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene has a molecular weight of 148.24 g/mol, XLogP of 3.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-Methyl-6-methylidene-4-(prop-1-en-2-yl)cyclohex-1-ene is sourced from PubChem (CID 24848565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).