6-methoxy-2,6-dimethylhept-2-ene

C10H20O — CID 14793993

IUPAC6-methoxy-2,6-dimethylhept-2-ene
SMILESCOC(C)(C)CCC=C(C)C
InChIInChI=1S/C10H20O/c1-9(2)7-6-8-10(3,4)11-5/h7H,6,8H2,1-5H3
InChIKeyZTCGPFZFONNVDZ-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.16
Rot. Bonds4

About 6-methoxy-2,6-dimethylhept-2-ene

6-methoxy-2,6-dimethylhept-2-ene (PubChem CID 14793993) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 6-methoxy-2,6-dimethylhept-2-ene.

Molecular Properties

Compound Name6-methoxy-2,6-dimethylhept-2-ene
PubChem CID14793993
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name6-methoxy-2,6-dimethylhept-2-ene
SMILESCOC(C)(C)CCC=C(C)C
InChIInChI=1S/C10H20O/c1-9(2)7-6-8-10(3,4)11-5/h7H,6,8H2,1-5H3
InChIKeyZTCGPFZFONNVDZ-UHFFFAOYSA-N
XLogP3.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 6-methoxy-2,6-dimethylhept-2-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

(3E)-7-methoxy-3,7-dimethylocta-1,3-diene
CID 88725055
5-methoxy-2,5-dimethylhex-2-ene
CID 10351802
7-methoxy-2,6,6-trimethyloct-2-ene
CID 89306696
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
(6E,10E,14E,16E,18E,20E,22E,26E)-31-methoxy-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,14,16,18,20,22,26-nonaene
CID 87443150
1-methoxy-3,7-dimethylocta-1,6-dien-3-ol
CID 154089045
(2E)-1-(2-methoxypropan-2-yloxy)-3,7-dimethylocta-2,6-diene
CID 10082427
3-ethenyl-3,7-dimethylocta-1,6-diene
CID 13122887
2,6,9,13-tetramethyltetradeca-2,12-dien-7-yne-6,9-diol
CID 12009845
2-methoxy-2,6,10,14,19,23,27,31-octamethyldotriaconta-6,8,10,12,14,16,18,20,22,24,26,30-dodecaen-5-one
CID 74089784
(4R)-4,8-dimethylnon-7-en-4-ol
CID 90181485
(6E)-2,6,10,10-tetramethylundeca-2,6-diene
CID 59164889

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,6-dimethylhept-2-ene?
The IUPAC name of 6-methoxy-2,6-dimethylhept-2-ene (CID 14793993) is 6-methoxy-2,6-dimethylhept-2-ene.
What is the SMILES notation for 6-methoxy-2,6-dimethylhept-2-ene?
The canonical SMILES for 6-methoxy-2,6-dimethylhept-2-ene is COC(C)(C)CCC=C(C)C.
What is the InChIKey of 6-methoxy-2,6-dimethylhept-2-ene?
The InChIKey is ZTCGPFZFONNVDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-9(2)7-6-8-10(3,4)11-5/h7H,6,8H2,1-5H3.
What are the key properties of 6-methoxy-2,6-dimethylhept-2-ene?
6-methoxy-2,6-dimethylhept-2-ene has a molecular weight of 156.27 g/mol, XLogP of 3.16, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,6-dimethylhept-2-ene is sourced from PubChem (CID 14793993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).