2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine

C11H9Cl2N3O — CID 114044146

IUPAC2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine
SMILESNc1cnc(Cl)nc1OCc1cccc(Cl)c1
InChIInChI=1S/C11H9Cl2N3O/c12-8-3-1-2-7(4-8)6-17-10-9(14)5-15-11(13)16-10/h1-5H,6,14H2
InChIKeyGVBZWPWJBONOAB-UHFFFAOYSA-N
MW270.12 g/mol
LogP2.94
Rot. Bonds3

About 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine

2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine (PubChem CID 114044146) has the molecular formula C11H9Cl2N3O and a molecular weight of 270.12 g/mol. Its IUPAC name is 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine.

Molecular Properties

Compound Name2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine
PubChem CID114044146
Molecular FormulaC11H9Cl2N3O
Molecular Weight270.12 g/mol
Exact Mass269.01
IUPAC Name2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine
SMILESNc1cnc(Cl)nc1OCc1cccc(Cl)c1
InChIInChI=1S/C11H9Cl2N3O/c12-8-3-1-2-7(4-8)6-17-10-9(14)5-15-11(13)16-10/h1-5H,6,14H2
InChIKeyGVBZWPWJBONOAB-UHFFFAOYSA-N
XLogP2.94
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.12
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine 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

5-bromo-2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidine
CID 79075950
2-[(3-chlorophenyl)methoxy]-5-methylpyridin-3-amine
CID 66279132
6-[(3-chlorophenyl)methoxy]-3,5-difluoropyridin-2-amine
CID 114073469
2-[(3-chlorophenyl)methoxy]pyrimidin-5-amine
CID 65127178
4-[(3-chlorophenyl)methoxy]pyridin-3-amine
CID 65126775
4-[(3-chlorophenyl)methoxy]-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103332823
6-[(3-chlorophenyl)methoxy]-7H-purin-2-amine
CID 5329518
5-amino-2-[(3-chlorophenyl)methoxy]pyridine-3-carboxamide
CID 65127179
3-chloro-4-[(3-chlorophenyl)methoxy]-1,2,5-thiadiazole
CID 65125047
6-bromo-4-[(3-chlorophenyl)methoxy]quinolin-3-amine
CID 65126875
5-chloro-2-[(3-chlorophenyl)methoxy]pyridine
CID 66232556
2-[(3-chlorophenyl)methoxy]-3-fluoroaniline
CID 104831215

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine?
The IUPAC name of 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine (CID 114044146) is 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine.
What is the SMILES notation for 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine?
The canonical SMILES for 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine is Nc1cnc(Cl)nc1OCc1cccc(Cl)c1.
What is the InChIKey of 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine?
The InChIKey is GVBZWPWJBONOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3O/c12-8-3-1-2-7(4-8)6-17-10-9(14)5-15-11(13)16-10/h1-5H,6,14H2.
What are the key properties of 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine?
2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine has a molecular weight of 270.12 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[(3-chlorophenyl)methoxy]pyrimidin-5-amine is sourced from PubChem (CID 114044146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).