1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene

C17H20O2 — CID 57200665

IUPAC1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene
SMILESCOc1ccc(C(C)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C17H20O2/c1-12-5-7-14(8-6-12)13(2)15-9-10-16(18-3)17(11-15)19-4/h5-11,13H,1-4H3
InChIKeyYKNSPMRZPNBLBY-UHFFFAOYSA-N
MW256.34 g/mol
LogP4.16
Rot. Bonds4

About 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene

1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene (PubChem CID 57200665) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene.

Molecular Properties

Compound Name1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene
PubChem CID57200665
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene
SMILESCOc1ccc(C(C)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C17H20O2/c1-12-5-7-14(8-6-12)13(2)15-9-10-16(18-3)17(11-15)19-4/h5-11,13H,1-4H3
InChIKeyYKNSPMRZPNBLBY-UHFFFAOYSA-N
XLogP4.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(S)-(3,4-dimethoxyphenyl)-(4-methylphenyl)methyl]azanium
CID 7183177
4-[1-(3,4-dimethoxyphenyl)ethyl]benzene-1,2-diol
CID 174965052
2-methoxy-1-methyl-4-(1-phenylethyl)benzene
CID 57234669
1,2-dimethoxy-4-(3-methylbutan-2-yl)benzene
CID 23378350
3,4-dimethoxy-N-(4-methylphenyl)-N-propan-2-ylaniline
CID 177401389
4-butan-2-yl-1,2-dimethoxybenzene
CID 54391207
1,2-bis(3,4-dimethoxyphenyl)ethane-1,2-diol
CID 11461770
1,2-dimethoxy-4-(4-methylphenyl)benzene;ethane
CID 142094347
[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-methylazanium
CID 6921093
2-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylphenyl)acetamide
CID 120667278
1-(3,4-dimethoxyphenyl)-N-(4-methylphenyl)ethane-1,2-diamine
CID 65378384
1-[chloro-(3,4-dimethoxyphenyl)methyl]-2,4-dimethylbenzene
CID 61081551

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene?
The IUPAC name of 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene (CID 57200665) is 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene.
What is the SMILES notation for 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene?
The canonical SMILES for 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene is COc1ccc(C(C)c2ccc(C)cc2)cc1OC.
What is the InChIKey of 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene?
The InChIKey is YKNSPMRZPNBLBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-12-5-7-14(8-6-12)13(2)15-9-10-16(18-3)17(11-15)19-4/h5-11,13H,1-4H3.
What are the key properties of 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene?
1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene has a molecular weight of 256.34 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxy-4-[1-(4-methylphenyl)ethyl]benzene is sourced from PubChem (CID 57200665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).