(4R)-4-dec-1-en-2-yl-1-methylcyclohexene

C17H30 — CID 71355646

IUPAC(4R)-4-dec-1-en-2-yl-1-methylcyclohexene
SMILESC=C(CCCCCCCC)[C@H]1CC=C(C)CC1
InChIInChI=1S/C17H30/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11,17H,3-10,12-14H2,1-2H3/t17-/m0/s1
InChIKeyFCEJPMCCKWAHHR-KRWDZBQOSA-N
MW234.43 g/mol
LogP6.04
Rot. Bonds8

About (4R)-4-dec-1-en-2-yl-1-methylcyclohexene

(4R)-4-dec-1-en-2-yl-1-methylcyclohexene (PubChem CID 71355646) has the molecular formula C17H30 and a molecular weight of 234.43 g/mol. Its IUPAC name is (4R)-4-dec-1-en-2-yl-1-methylcyclohexene.

Molecular Properties

Compound Name(4R)-4-dec-1-en-2-yl-1-methylcyclohexene
PubChem CID71355646
Molecular FormulaC17H30
Molecular Weight234.43 g/mol
Exact Mass234.23
IUPAC Name(4R)-4-dec-1-en-2-yl-1-methylcyclohexene
SMILESC=C(CCCCCCCC)[C@H]1CC=C(C)CC1
InChIInChI=1S/C17H30/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11,17H,3-10,12-14H2,1-2H3/t17-/m0/s1
InChIKeyFCEJPMCCKWAHHR-KRWDZBQOSA-N
XLogP6.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500234.43
LogP ≤ 56.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-dec-1-en-2-yl-1-methylcyclohexene
CID 71334029
2-methyl-6-(4-methylcyclohex-3-en-1-yl)hept-6-en-3-one
CID 101417495
2-[(1R,3E,7E,11Z)-4,8,12-trimethylcyclotetradeca-3,7,11-trien-1-yl]prop-2-en-1-ol
CID 162979142
2-methyl-6-(4-methylcyclohex-3-en-1-yl)hepta-2,6-dien-1-ol
CID 529890
(2E)-2-methyl-6-[(1R)-4-methylcyclohex-3-en-1-yl]hepta-2,6-dien-1-ol
CID 158432615
ethane-1,2-diol;1-methyl-4-prop-1-en-2-ylcyclohexene
CID 67811623
(4R)-1-methyl-4-[(5Z,10S,14S,18S)-6,10,14,18,22-pentamethyltricosa-1,5-dien-2-yl]cyclohexene
CID 162876231
1-methyl-4-[(5E)-6,10,14,18,22-pentamethyltricosa-1,5-dien-2-yl]cyclohexene
CID 101380860
1-(4-acetylcyclohexen-1-yl)heptan-1-one
CID 10037125
(1E,5E,8R,10R)-1,5-dimethyl-8,10-bis(prop-1-en-2-yl)cyclododeca-1,5-diene
CID 14192378
[(1E,4R,7E,11E)-7,11-dimethyl-4-(6-methylhepta-1,5-dien-2-yl)cyclotetradeca-1,7,11-trien-1-yl]methanol
CID 162947061
ethane;4-methylcyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene
CID 143245192

Frequently Asked Questions

What is the IUPAC name of (4R)-4-dec-1-en-2-yl-1-methylcyclohexene?
The IUPAC name of (4R)-4-dec-1-en-2-yl-1-methylcyclohexene (CID 71355646) is (4R)-4-dec-1-en-2-yl-1-methylcyclohexene.
What is the SMILES notation for (4R)-4-dec-1-en-2-yl-1-methylcyclohexene?
The canonical SMILES for (4R)-4-dec-1-en-2-yl-1-methylcyclohexene is C=C(CCCCCCCC)[C@H]1CC=C(C)CC1.
What is the InChIKey of (4R)-4-dec-1-en-2-yl-1-methylcyclohexene?
The InChIKey is FCEJPMCCKWAHHR-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H30/c1-4-5-6-7-8-9-10-16(3)17-13-11-15(2)12-14-17/h11,17H,3-10,12-14H2,1-2H3/t17-/m0/s1.
What are the key properties of (4R)-4-dec-1-en-2-yl-1-methylcyclohexene?
(4R)-4-dec-1-en-2-yl-1-methylcyclohexene has a molecular weight of 234.43 g/mol, XLogP of 6.04, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-dec-1-en-2-yl-1-methylcyclohexene is sourced from PubChem (CID 71355646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).