2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine

C10H6Cl3N3 — CID 88722654

IUPAC2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine
SMILESClc1cc(Nc2ccccc2Cl)nc(Cl)n1
InChIInChI=1S/C10H6Cl3N3/c11-6-3-1-2-4-7(6)14-9-5-8(12)15-10(13)16-9/h1-5H,(H,14,15,16)
InChIKeyQJULCRJJFSEEGT-UHFFFAOYSA-N
MW274.54 g/mol
LogP4.18
Rot. Bonds2

About 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine

2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine (PubChem CID 88722654) has the molecular formula C10H6Cl3N3 and a molecular weight of 274.54 g/mol. Its IUPAC name is 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine
PubChem CID88722654
Molecular FormulaC10H6Cl3N3
Molecular Weight274.54 g/mol
Exact Mass272.96
IUPAC Name2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine
SMILESClc1cc(Nc2ccccc2Cl)nc(Cl)n1
InChIInChI=1S/C10H6Cl3N3/c11-6-3-1-2-4-7(6)14-9-5-8(12)15-10(13)16-9/h1-5H,(H,14,15,16)
InChIKeyQJULCRJJFSEEGT-UHFFFAOYSA-N
XLogP4.18
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.54
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine?
The IUPAC name of 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine (CID 88722654) is 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine.
What is the SMILES notation for 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine?
The canonical SMILES for 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine is Clc1cc(Nc2ccccc2Cl)nc(Cl)n1.
What is the InChIKey of 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine?
The InChIKey is QJULCRJJFSEEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl3N3/c11-6-3-1-2-4-7(6)14-9-5-8(12)15-10(13)16-9/h1-5H,(H,14,15,16).
What are the key properties of 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine?
2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine has a molecular weight of 274.54 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(2-chlorophenyl)pyrimidin-4-amine is sourced from PubChem (CID 88722654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).