(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol

C15H24O3 — CID 101173431

IUPAC(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol
SMILESCCCC[C@H](CO)COCc1ccc(OC)cc1
InChIInChI=1S/C15H24O3/c1-3-4-5-14(10-16)12-18-11-13-6-8-15(17-2)9-7-13/h6-9,14,16H,3-5,10-12H2,1-2H3/t14-/m1/s1
InChIKeyQXOKCGHHRPIIFJ-CQSZACIVSA-N
MW252.35 g/mol
LogP3.01
Rot. Bonds9

About (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol

(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol (PubChem CID 101173431) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol
PubChem CID101173431
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol
SMILESCCCC[C@H](CO)COCc1ccc(OC)cc1
InChIInChI=1S/C15H24O3/c1-3-4-5-14(10-16)12-18-11-13-6-8-15(17-2)9-7-13/h6-9,14,16H,3-5,10-12H2,1-2H3/t14-/m1/s1
InChIKeyQXOKCGHHRPIIFJ-CQSZACIVSA-N
XLogP3.01
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol 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

2-[(4-methoxyphenyl)methyl]heptan-1-ol
CID 66060559
5-[(4-methoxyphenyl)methoxy]-2-[3-[(4-methoxyphenyl)methoxy]propyl]pentan-1-ol
CID 11025823
2-[3-[(4-methoxyphenyl)methoxy]propyl]propane-1,3-diol
CID 24742721
4-ethyl-2-[(4-methoxyphenyl)methyl]octan-1-ol
CID 66058427
1-[[(2R)-2-iodododecoxy]methyl]-4-methoxybenzene
CID 101441069
4-[(4-methoxyphenyl)methoxy]butane-1,3-diol
CID 44629983
(3S,5R)-6-[(4-methoxyphenyl)methoxy]-3,5-dimethylhexan-1-ol
CID 11219333
2-[(4-methoxyphenyl)methyl]propane-1,3-diol
CID 11008852
N-[[4-(2-ethylhexoxymethyl)phenyl]methyl]ethanamine
CID 63491260
(2R,3S)-2-amino-4-[(4-methoxyphenyl)methoxy]-3-methylbutan-1-ol
CID 10857567
1-tert-butyl-4-(2-ethylhexoxymethyl)benzene
CID 134220783
2-[(4-methoxyphenyl)methyl]-N-methylhexan-1-amine
CID 55083396

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol?
The IUPAC name of (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol (CID 101173431) is (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol.
What is the SMILES notation for (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol?
The canonical SMILES for (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol is CCCC[C@H](CO)COCc1ccc(OC)cc1.
What is the InChIKey of (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol?
The InChIKey is QXOKCGHHRPIIFJ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24O3/c1-3-4-5-14(10-16)12-18-11-13-6-8-15(17-2)9-7-13/h6-9,14,16H,3-5,10-12H2,1-2H3/t14-/m1/s1.
What are the key properties of (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol?
(2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol has a molecular weight of 252.35 g/mol, XLogP of 3.01, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-methoxyphenyl)methoxymethyl]hexan-1-ol is sourced from PubChem (CID 101173431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).