2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine

C19H17ClN2O2 — CID 95922512

IUPAC2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine
SMILESCOc1cccc(COc2cc(C)nc(-c3cccc(Cl)c3)n2)c1
InChIInChI=1S/C19H17ClN2O2/c1-13-9-18(24-12-14-5-3-8-17(10-14)23-2)22-19(21-13)15-6-4-7-16(20)11-15/h3-11H,12H2,1-2H3
InChIKeyUJAFHOZDQUCYIB-UHFFFAOYSA-N
MW340.81 g/mol
LogP4.69
Rot. Bonds5

About 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine

2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine (PubChem CID 95922512) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine
PubChem CID95922512
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC Name2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine
SMILESCOc1cccc(COc2cc(C)nc(-c3cccc(Cl)c3)n2)c1
InChIInChI=1S/C19H17ClN2O2/c1-13-9-18(24-12-14-5-3-8-17(10-14)23-2)22-19(21-13)15-6-4-7-16(20)11-15/h3-11H,12H2,1-2H3
InChIKeyUJAFHOZDQUCYIB-UHFFFAOYSA-N
XLogP4.69
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine 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-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine
CID 95923139
2-chloro-4-[(3-chlorophenyl)methoxy]-6-methylpyrimidine
CID 65124564
1-chloro-3-[(3-methoxyphenyl)methoxy]benzene
CID 60627845
4-chloro-6-[(3-methoxyphenyl)methoxy]pyrimidin-2-amine
CID 80740138
4-[(3-methoxyphenyl)methoxy]-6-methyl-2-piperidin-1-ylpyrimidine
CID 75358366
5-[[2-(3-chlorophenyl)-6-methylpyrimidin-4-yl]oxymethyl]-3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazole
CID 95922525
2-(4-fluorophenyl)-4-[(3-fluorophenyl)methoxy]-6-methylpyrimidine
CID 95922322
1-chloro-3-[(4-methoxyphenoxy)methyl]benzene
CID 112788879
2-chloro-6-[(3-methoxyphenyl)methoxy]pyridine-4-carboxylic acid
CID 43343574
2-[2-(3-chlorophenyl)-6-methylpyrimidin-4-yl]oxy-N-(3,4,5-trimethoxyphenyl)acetamide
CID 95922519
3-chloro-6-[(3-methoxyphenyl)methoxy]pyridazine
CID 24702532
4-(chloromethyl)-2-(3-methoxyphenyl)-6-methylpyrimidine
CID 55114193

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine?
The IUPAC name of 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine (CID 95922512) is 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine.
What is the SMILES notation for 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine?
The canonical SMILES for 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine is COc1cccc(COc2cc(C)nc(-c3cccc(Cl)c3)n2)c1.
What is the InChIKey of 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine?
The InChIKey is UJAFHOZDQUCYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c1-13-9-18(24-12-14-5-3-8-17(10-14)23-2)22-19(21-13)15-6-4-7-16(20)11-15/h3-11H,12H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine?
2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine has a molecular weight of 340.81 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methoxy]-6-methylpyrimidine is sourced from PubChem (CID 95922512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).