[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol

C18H22O4 — CID 23043876

IUPAC[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol
SMILESCOc1ccc(CCc2c(CO)ccc(OC)c2OC)cc1
InChIInChI=1S/C18H22O4/c1-20-15-8-4-13(5-9-15)6-10-16-14(12-19)7-11-17(21-2)18(16)22-3/h4-5,7-9,11,19H,6,10,12H2,1-3H3
InChIKeyUWPKYKRYZMRVQS-UHFFFAOYSA-N
MW302.37 g/mol
LogP2.99
Rot. Bonds7

About [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol

[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol (PubChem CID 23043876) has the molecular formula C18H22O4 and a molecular weight of 302.37 g/mol. Its IUPAC name is [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol.

Molecular Properties

Compound Name[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol
PubChem CID23043876
Molecular FormulaC18H22O4
Molecular Weight302.37 g/mol
Exact Mass302.15
IUPAC Name[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol
SMILESCOc1ccc(CCc2c(CO)ccc(OC)c2OC)cc1
InChIInChI=1S/C18H22O4/c1-20-15-8-4-13(5-9-15)6-10-16-14(12-19)7-11-17(21-2)18(16)22-3/h4-5,7-9,11,19H,6,10,12H2,1-3H3
InChIKeyUWPKYKRYZMRVQS-UHFFFAOYSA-N
XLogP2.99
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3,4-dimethoxy-2-[2-(3,4,5-trimethoxyphenyl)ethyl]phenyl]methanol
CID 23044013
2-(hydroxymethyl)-4-[2-(4-methoxyphenyl)ethyl]phenol
CID 70230717
(2-amino-3,4-dimethoxyphenyl)methanol
CID 139735105
(4-methoxyphenyl)methanol
CID 7738
3,4-dimethoxy-2-[(4-methoxyphenyl)methyl]benzoic acid
CID 11289635
1-[4,5-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]-4,5-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]benzene
CID 172870969
3-(2,3,4-trimethoxyphenyl)propan-1-ol
CID 11790895
[2-[2-(4-methoxyphenyl)ethoxy]-5-methylphenyl]methanol
CID 65446582
1-[(4-methoxyphenyl)methyl]-3-[[2-(2,3,4-trimethoxyphenyl)acetyl]amino]thiourea
CID 9086023
4-[2-(4-hydroxyphenyl)ethyl]-2-[2-methoxy-5-[2-(4-methoxyphenyl)ethyl]phenyl]phenol
CID 172870463
1,2-dimethoxy-4-[2-[2-[2-(4-methoxyphenyl)ethyl]phenyl]ethyl]benzene
CID 170457351
1,2,3-trimethoxy-5-[2-[3-[2-(4-methoxyphenyl)ethyl]phenyl]ethyl]benzene
CID 171715581

Frequently Asked Questions

What is the IUPAC name of [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol?
The IUPAC name of [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol (CID 23043876) is [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol.
What is the SMILES notation for [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol?
The canonical SMILES for [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol is COc1ccc(CCc2c(CO)ccc(OC)c2OC)cc1.
What is the InChIKey of [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol?
The InChIKey is UWPKYKRYZMRVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O4/c1-20-15-8-4-13(5-9-15)6-10-16-14(12-19)7-11-17(21-2)18(16)22-3/h4-5,7-9,11,19H,6,10,12H2,1-3H3.
What are the key properties of [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol?
[3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol has a molecular weight of 302.37 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]methanol is sourced from PubChem (CID 23043876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).