[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol

C14H22O4 — CID 103034160

IUPAC[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol
SMILESCOc1cccc(CO)c1OCCC(C)(C)OC
InChIInChI=1S/C14H22O4/c1-14(2,17-4)8-9-18-13-11(10-15)6-5-7-12(13)16-3/h5-7,15H,8-10H2,1-4H3
InChIKeyPILZFSUZVOESAZ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.38
Rot. Bonds7

About [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol

[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol (PubChem CID 103034160) has the molecular formula C14H22O4 and a molecular weight of 254.33 g/mol. Its IUPAC name is [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol
PubChem CID103034160
Molecular FormulaC14H22O4
Molecular Weight254.33 g/mol
Exact Mass254.15
IUPAC Name[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol
SMILESCOc1cccc(CO)c1OCCC(C)(C)OC
InChIInChI=1S/C14H22O4/c1-14(2,17-4)8-9-18-13-11(10-15)6-5-7-12(13)16-3/h5-7,15H,8-10H2,1-4H3
InChIKeyPILZFSUZVOESAZ-UHFFFAOYSA-N
XLogP2.38
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-methoxy-2-(3,3,3-trifluoropropoxy)phenyl]methanol
CID 64567950
[2-(3-methoxy-3-methylbutoxy)phenyl]methanol
CID 102975241
[2-[2-(dimethylamino)ethoxy]-3-methoxyphenyl]methanol
CID 43471611
(3-methoxy-2-nonoxyphenyl)methanol
CID 43471510
3-[2-(hydroxymethyl)-6-methoxyphenoxy]-2,2-dimethylpropanoic acid
CID 79623918
3-[[2-(hydroxymethyl)-6-methoxyphenoxy]methyl]pentan-3-ol
CID 114494393
[2-(2,2-difluoroethoxy)-3-methoxyphenyl]methanol
CID 60922673
2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide
CID 964386
[2-(cyclopropylmethoxy)-3-methoxyphenyl]methanol
CID 43560490
4-(2,6-dimethoxyphenoxy)-2-methylbutan-2-amine
CID 28917828
[3-methoxy-2-(3,3,3-trifluoropropoxy)phenyl]methanamine
CID 64552071
[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methanol
CID 2987070

Frequently Asked Questions

What is the IUPAC name of [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol?
The IUPAC name of [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol (CID 103034160) is [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol.
What is the SMILES notation for [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol?
The canonical SMILES for [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol is COc1cccc(CO)c1OCCC(C)(C)OC.
What is the InChIKey of [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol?
The InChIKey is PILZFSUZVOESAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O4/c1-14(2,17-4)8-9-18-13-11(10-15)6-5-7-12(13)16-3/h5-7,15H,8-10H2,1-4H3.
What are the key properties of [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol?
[3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol has a molecular weight of 254.33 g/mol, XLogP of 2.38, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methoxy-2-(3-methoxy-3-methylbutoxy)phenyl]methanol is sourced from PubChem (CID 103034160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).