1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol

C16H17ClO2 — CID 61261227

IUPAC1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)Cc1ccccc1Cl
InChIInChI=1S/C16H17ClO2/c1-19-16-9-5-3-7-13(16)11-14(18)10-12-6-2-4-8-15(12)17/h2-9,14,18H,10-11H2,1H3
InChIKeyVWTIQUQGZBCVGJ-UHFFFAOYSA-N
MW276.76 g/mol
LogP3.49
Rot. Bonds5

About 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol

1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol (PubChem CID 61261227) has the molecular formula C16H17ClO2 and a molecular weight of 276.76 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol
PubChem CID61261227
Molecular FormulaC16H17ClO2
Molecular Weight276.76 g/mol
Exact Mass276.09
IUPAC Name1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol
SMILESCOc1ccccc1CC(O)Cc1ccccc1Cl
InChIInChI=1S/C16H17ClO2/c1-19-16-9-5-3-7-13(16)11-14(18)10-12-6-2-4-8-15(12)17/h2-9,14,18H,10-11H2,1H3
InChIKeyVWTIQUQGZBCVGJ-UHFFFAOYSA-N
XLogP3.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.76
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-chloro-2-methoxyphenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 62608604
1-(2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 61263658
1-(2-chlorophenyl)-3-(4-methoxyphenyl)propan-2-ol
CID 61373626
1-(4-chloro-2-fluorophenyl)-3-(2-methoxyphenyl)propan-2-ol
CID 114854536
(2R)-1-(2-methoxyphenyl)propan-2-ol
CID 6951555
1-(2-methoxyphenyl)-4,4-dimethylpentan-2-ol
CID 63018076
1-(dimethylamino)-3-(2-methoxyphenyl)propan-2-ol
CID 79088057
1-(2-methoxyphenyl)-3-(methylamino)propan-2-ol
CID 64983172
1-(4-chlorophenoxy)-3-(2-methoxyphenyl)propan-2-ol
CID 105081523
(2R)-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-2-ol;4,4,4-trifluoro-1-(2-methoxyphenyl)butan-2-ol
CID 158657667
1-(2-methoxyphenyl)hexan-2-ol
CID 62607835
1-(2-methoxyphenyl)-3-phenylsulfanylpropan-2-ol
CID 65142108

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol (CID 61261227) is 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol is COc1ccccc1CC(O)Cc1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol?
The InChIKey is VWTIQUQGZBCVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO2/c1-19-16-9-5-3-7-13(16)11-14(18)10-12-6-2-4-8-15(12)17/h2-9,14,18H,10-11H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol?
1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol has a molecular weight of 276.76 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-3-(2-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 61261227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).