methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene

C43H92 — CID 162137230

IUPACmethane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene
SMILESC.C.C.C/C(=C/C(C)C)CC(C)C.C/C(=C\C(C)C)CC(C)C.C/C=C(/CC(C)C)C(C)C.C/C=C(\CC(C)C)C(C)C
InChIInChI=1S/4C10H20.3CH4/c2*1-8(2)6-10(5)7-9(3)4;2*1-6-10(9(4)5)7-8(2)3;;;/h4*6,8-9H,7H2,1-5H3;3*1H4/b10-6+;10-6-;10-6+;10-6-;;;
InChIKeyZJLJMWDZDUSSSK-RVBRLQHLSA-N
MW609.21 g/mol
LogP16.45
Rot. Bonds12

About methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene

methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene (PubChem CID 162137230) has the molecular formula C43H92 and a molecular weight of 609.21 g/mol. Its IUPAC name is methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene.

Molecular Properties

Compound Namemethane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene
PubChem CID162137230
Molecular FormulaC43H92
Molecular Weight609.21 g/mol
Exact Mass608.72
IUPAC Namemethane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene
SMILESC.C.C.C/C(=C/C(C)C)CC(C)C.C/C(=C\C(C)C)CC(C)C.C/C=C(/CC(C)C)C(C)C.C/C=C(\CC(C)C)C(C)C
InChIInChI=1S/4C10H20.3CH4/c2*1-8(2)6-10(5)7-9(3)4;2*1-6-10(9(4)5)7-8(2)3;;;/h4*6,8-9H,7H2,1-5H3;3*1H4/b10-6+;10-6-;10-6+;10-6-;;;
InChIKeyZJLJMWDZDUSSSK-RVBRLQHLSA-N
XLogP16.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500609.21
LogP ≤ 516.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-dimethyl-4-propan-2-ylhept-3-ene
CID 123759712
(E)-1-iodo-2,4-dimethylpent-1-ene
CID 58173205
[(Z)-2,5-dimethylhex-3-en-3-yl]cyclopropane;2,5-dimethylhex-3-yne;(E)-3-ethyl-2,5-dimethylhex-3-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(E)-2,3,4,5-tetramethylhex-3-ene
CID 162179995
2,4-dimethylpent-2-en-1-ol
CID 54511819
(Z)-2,4-dimethylhex-3-ene
CID 5463169
(5E)-2,5,7-trimethyl-3-propan-2-ylocta-1,5-diene
CID 102247681
(E)-3,5-dimethylhex-2-en-1-ol
CID 13415310
(E)-3,5-dimethylhex-3-en-2-one;methane;3-methylbutanoic acid
CID 161004203
5,7-dimethyloct-4-enal
CID 154103325
2,4-dimethyl-N-(2-methylpropyl)pent-2-en-1-amine
CID 79341169
2,4,6,6-tetramethylhept-3-ene
CID 76726617
2,7-dimethyl-4-propan-2-yloct-3-ene
CID 123373088

Frequently Asked Questions

What is the IUPAC name of methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene?
The IUPAC name of methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene (CID 162137230) is methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene.
What is the SMILES notation for methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene?
The canonical SMILES for methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene is C.C.C.C/C(=C/C(C)C)CC(C)C.C/C(=C\C(C)C)CC(C)C.C/C=C(/CC(C)C)C(C)C.C/C=C(\CC(C)C)C(C)C.
What is the InChIKey of methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene?
The InChIKey is ZJLJMWDZDUSSSK-RVBRLQHLSA-N. The full InChI is InChI=1S/4C10H20.3CH4/c2*1-8(2)6-10(5)7-9(3)4;2*1-6-10(9(4)5)7-8(2)3;;;/h4*6,8-9H,7H2,1-5H3;3*1H4/b10-6+;10-6-;10-6+;10-6-;;;.
What are the key properties of methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene?
methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene has a molecular weight of 609.21 g/mol, XLogP of 16.45, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;(Z)-5-methyl-3-propan-2-ylhex-2-ene;(E)-5-methyl-3-propan-2-ylhex-2-ene;(Z)-2,4,6-trimethylhept-3-ene;(E)-2,4,6-trimethylhept-3-ene is sourced from PubChem (CID 162137230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).