1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol

C16H17ClO3 — CID 105081523

IUPAC1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)COc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClO3/c1-19-16-5-3-2-4-12(16)10-14(18)11-20-15-8-6-13(17)7-9-15/h2-9,14,18H,10-11H2,1H3
InChIKeyOACBOJRJQXZDBG-UHFFFAOYSA-N
MW292.76 g/mol
LogP3.33
Rot. Bonds6

About 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol

1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol (PubChem CID 105081523) has the molecular formula C16H17ClO3 and a molecular weight of 292.76 g/mol. Its IUPAC name is 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol
PubChem CID105081523
Molecular FormulaC16H17ClO3
Molecular Weight292.76 g/mol
Exact Mass292.09
IUPAC Name1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)COc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClO3/c1-19-16-5-3-2-4-12(16)10-14(18)11-20-15-8-6-13(17)7-9-15/h2-9,14,18H,10-11H2,1H3
InChIKeyOACBOJRJQXZDBG-UHFFFAOYSA-N
XLogP3.33
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.76
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-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

1-[benzyl-[(2-methoxyphenyl)methyl]amino]-3-(4-chlorophenoxy)propan-2-ol
CID 46007695
1-(4-chlorophenoxy)-3-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]propan-2-ol
CID 46007702
1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 62608604
1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61261227
1-(3-chloro-2-fluorophenyl)-3-(4-chlorophenoxy)propan-2-ol
CID 102867534
1-(4-chloro-2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 114854536
1-(2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61263658
2-(4-chlorophenoxy)-3-(2-methoxyphenyl)propanoic acid
CID 133240973
1-(2-aminophenoxy)-3-(4-chlorophenoxy)propan-2-ol
CID 62267239
1-(4-chloro-2-fluorophenyl)-3-(4-chlorophenoxy)propan-2-ol
CID 105132914
1-(2-chloro-4-methylphenyl)-3-(4-chlorophenoxy)propan-2-ol
CID 106868107
1-(4-chlorophenoxy)-3-(4-methylphenyl)propan-2-ol
CID 105077329

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol (CID 105081523) is 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol is COc1ccccc1CC(O)COc1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol?
The InChIKey is OACBOJRJQXZDBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO3/c1-19-16-5-3-2-4-12(16)10-14(18)11-20-15-8-6-13(17)7-9-15/h2-9,14,18H,10-11H2,1H3.
What are the key properties of 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol?
1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol has a molecular weight of 292.76 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 105081523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).