3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol

C12H18O3 — CID 65313094

IUPAC3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
SMILESCOCCC(O)c1ccc(OC)cc1C
InChIInChI=1S/C12H18O3/c1-9-8-10(15-3)4-5-11(9)12(13)6-7-14-2/h4-5,8,12-13H,6-7H2,1-3H3
InChIKeyBTAJAVJKCASEKR-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.07
Rot. Bonds5

About 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol

3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol (PubChem CID 65313094) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
PubChem CID65313094
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
SMILESCOCCC(O)c1ccc(OC)cc1C
InChIInChI=1S/C12H18O3/c1-9-8-10(15-3)4-5-11(9)12(13)6-7-14-2/h4-5,8,12-13H,6-7H2,1-3H3
InChIKeyBTAJAVJKCASEKR-UHFFFAOYSA-N
XLogP2.07
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 105083019
1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 13147116
1-(4-methoxy-2-methylphenyl)octan-1-ol
CID 61101302
3-ethylsulfanyl-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 116504533
1-(4-methoxy-2-methylphenyl)-2-propoxyethanol
CID 65313194
3,3,3-trifluoro-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 61101293
1-(2,4-dimethoxyphenyl)-3-(2-methoxyethoxy)propan-1-ol
CID 102927728
3-(furan-2-yl)-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 105082960
1-(4-methoxy-2-methylphenyl)-3-piperazin-1-ylpropan-1-ol
CID 82074465
1-(4-bromo-2-methylphenyl)-4-methoxybutan-1-ol
CID 115839496
[3-(2-methoxyethoxy)-1-(4-methoxy-2-methylphenyl)propyl]hydrazine
CID 102930044
2,2-dichloro-1-(4-methoxy-2-methylphenyl)ethanol
CID 164892247

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol?
The IUPAC name of 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol (CID 65313094) is 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol.
What is the SMILES notation for 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol?
The canonical SMILES for 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol is COCCC(O)c1ccc(OC)cc1C.
What is the InChIKey of 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol?
The InChIKey is BTAJAVJKCASEKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-9-8-10(15-3)4-5-11(9)12(13)6-7-14-2/h4-5,8,12-13H,6-7H2,1-3H3.
What are the key properties of 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol?
3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol has a molecular weight of 210.27 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(4-methoxy-2-methylphenyl)propan-1-ol is sourced from PubChem (CID 65313094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).