2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene

C15H22O2 — CID 177482757

IUPAC2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1ccc(OC(C)(C)CC)c(OC)c1
InChIInChI=1S/C15H22O2/c1-6-8-12-9-10-13(14(11-12)16-5)17-15(3,4)7-2/h6,8-11H,7H2,1-5H3/b8-6-
InChIKeyCLDUVKHLYXKYIM-VURMDHGXSA-N
MW234.34 g/mol
LogP4.30
Rot. Bonds5

About 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene

2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene (PubChem CID 177482757) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene.

Molecular Properties

Compound Name2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene
PubChem CID177482757
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene
SMILESC/C=C\c1ccc(OC(C)(C)CC)c(OC)c1
InChIInChI=1S/C15H22O2/c1-6-8-12-9-10-13(14(11-12)16-5)17-15(3,4)7-2/h6,8-11H,7H2,1-5H3/b8-6-
InChIKeyCLDUVKHLYXKYIM-VURMDHGXSA-N
XLogP4.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methoxy-4-[(E)-prop-1-enyl]aniline
CID 162444147
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]ethanamine
CID 62582661
N-[2-(2-methoxy-4-prop-1-enylphenoxy)propyl]-2-methylpropan-2-amine
CID 76946776
1-(2-methoxy-4-prop-1-enylphenoxy)butan-2-one
CID 76931733
2-methoxy-5-prop-1-enylaniline
CID 853489
2-methoxy-5-[(Z)-prop-1-enyl]aniline
CID 45052602
2-(2-methoxy-4-prop-1-enylphenoxy)butan-1-amine
CID 76976965
N-[2-(2-methoxy-4-prop-1-enylphenoxy)ethyl]-3,3-dimethylbutan-1-amine
CID 76946730
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N,N-dimethylethanamine
CID 888309
1,2-dimethoxy-4-penta-1,3-dienylbenzene
CID 141114401
2-fluoro-1-methoxy-4-[(Z)-prop-1-enyl]benzene
CID 89214700
ethyl 2-(2-methoxy-4-prop-1-enylphenoxy)propanoate
CID 76914392

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene?
The IUPAC name of 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene (CID 177482757) is 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene.
What is the SMILES notation for 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene?
The canonical SMILES for 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene is C/C=C\c1ccc(OC(C)(C)CC)c(OC)c1.
What is the InChIKey of 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene?
The InChIKey is CLDUVKHLYXKYIM-VURMDHGXSA-N. The full InChI is InChI=1S/C15H22O2/c1-6-8-12-9-10-13(14(11-12)16-5)17-15(3,4)7-2/h6,8-11H,7H2,1-5H3/b8-6-.
What are the key properties of 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene?
2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene has a molecular weight of 234.34 g/mol, XLogP of 4.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-methylbutan-2-yloxy)-4-[(Z)-prop-1-enyl]benzene is sourced from PubChem (CID 177482757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).