2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene

C19H22O2 — CID 167431142

IUPAC2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene
SMILESCCCc1ccc(OC=C(C)c2ccccc2)c(OC)c1
InChIInChI=1S/C19H22O2/c1-4-8-16-11-12-18(19(13-16)20-3)21-14-15(2)17-9-6-5-7-10-17/h5-7,9-14H,4,8H2,1-3H3
InChIKeyPFWWZBOHWWRPLU-UHFFFAOYSA-N
MW282.38 g/mol
LogP5.09
Rot. Bonds6

About 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene

2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene (PubChem CID 167431142) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene.

Molecular Properties

Compound Name2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene
PubChem CID167431142
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene
SMILESCCCc1ccc(OC=C(C)c2ccccc2)c(OC)c1
InChIInChI=1S/C19H22O2/c1-4-8-16-11-12-18(19(13-16)20-3)21-14-15(2)17-9-6-5-7-10-17/h5-7,9-14H,4,8H2,1-3H3
InChIKeyPFWWZBOHWWRPLU-UHFFFAOYSA-N
XLogP5.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.38
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-1-(2-methoxy-2-phenylethenoxy)-4-propylbenzene
CID 156791300
1,2-dimethoxy-4-propylbenzene;methane
CID 159623020
1,3-dimethoxy-5-[(E)-2-phenylprop-1-enyl]-2-propylbenzene
CID 70001014
ethane;2-methoxy-4-propylphenol
CID 144852330
2-(2-methoxy-4-prop-2-enylphenoxy)ethene-1,1-diol
CID 146301981
[4-(2-aminoethyl)-2-methoxyphenyl] benzoate
CID 14622436
[4-[2-(3,4-dimethoxyphenyl)ethyl]-2,6-dimethoxyphenyl] benzoate
CID 171345656
1-iodo-2-methoxy-4-propylbenzene
CID 118402577
1-(1-phenylprop-1-en-2-yl)-4-propylbenzene
CID 57256038
2-(1-isocyanoethyl)-1-methoxy-4-propylbenzene
CID 4269004
(NZ)-N-[2-(3,4-dimethoxyphenyl)-1-phenylethylidene]hydroxylamine
CID 134924868
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-5-phenylpentanamide
CID 20969090

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene?
The IUPAC name of 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene (CID 167431142) is 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene.
What is the SMILES notation for 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene?
The canonical SMILES for 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene is CCCc1ccc(OC=C(C)c2ccccc2)c(OC)c1.
What is the InChIKey of 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene?
The InChIKey is PFWWZBOHWWRPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-4-8-16-11-12-18(19(13-16)20-3)21-14-15(2)17-9-6-5-7-10-17/h5-7,9-14H,4,8H2,1-3H3.
What are the key properties of 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene?
2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene has a molecular weight of 282.38 g/mol, XLogP of 5.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(2-phenylprop-1-enoxy)-4-propylbenzene is sourced from PubChem (CID 167431142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).