1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol

C15H16ClNO2 — CID 105092299

IUPAC1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol
SMILESCOc1ccc(Cl)cc1C(O)CCc1cccnc1
InChIInChI=1S/C15H16ClNO2/c1-19-15-7-5-12(16)9-13(15)14(18)6-4-11-3-2-8-17-10-11/h2-3,5,7-10,14,18H,4,6H2,1H3
InChIKeyJIJBLLSYHZJLIO-UHFFFAOYSA-N
MW277.75 g/mol
LogP3.41
Rot. Bonds5

About 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol

1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol (PubChem CID 105092299) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol
PubChem CID105092299
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol
SMILESCOc1ccc(Cl)cc1C(O)CCc1cccnc1
InChIInChI=1S/C15H16ClNO2/c1-19-15-7-5-12(16)9-13(15)14(18)6-4-11-3-2-8-17-10-11/h2-3,5,7-10,14,18H,4,6H2,1H3
InChIKeyJIJBLLSYHZJLIO-UHFFFAOYSA-N
XLogP3.41
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-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

1-(2,4-dimethoxyphenyl)-3-pyridin-3-ylpropan-1-ol
CID 105096059
1-(5-chloro-2-methoxyphenyl)-2-pyridin-4-ylethanol
CID 55116184
1-(4-chloro-2-methoxyphenyl)-3-phenylpropan-1-ol
CID 114978934
1-(2-fluorophenyl)-3-pyridin-3-ylpropan-1-ol
CID 105083957
1-(2,5-difluorophenyl)-3-pyridin-3-ylpropan-1-ol
CID 105094895
(2R)-2-(5-chloro-2-methoxyphenyl)-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]acetic acid
CID 97207767
1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol
CID 105122276
1-(5-chloro-2-methoxyphenyl)-2-phenoxyethanol
CID 62790142
1-(5-chloro-2-methoxyphenyl)-3-methylsulfonylpropan-1-ol
CID 115790708
1-(4-chlorophenyl)-4-pyridin-3-ylbutan-2-ol
CID 105076712
1-(5-chloro-2-methoxyphenyl)-4-methylsulfonylbutan-1-ol
CID 115780241
1-(3-fluoro-4-methoxyphenyl)-4-pyridin-3-ylbutan-2-amine
CID 105122507

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol (CID 105092299) is 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol is COc1ccc(Cl)cc1C(O)CCc1cccnc1.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol?
The InChIKey is JIJBLLSYHZJLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2/c1-19-15-7-5-12(16)9-13(15)14(18)6-4-11-3-2-8-17-10-11/h2-3,5,7-10,14,18H,4,6H2,1H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol?
1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol has a molecular weight of 277.75 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol is sourced from PubChem (CID 105092299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).