2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine

C6H5Cl2N3O — CID 155226394

IUPAC2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine
SMILESClc1nc(Cl)nc(OC2CC2)n1
InChIInChI=1S/C6H5Cl2N3O/c7-4-9-5(8)11-6(10-4)12-3-1-2-3/h3H,1-2H2
InChIKeyBVXPRJRAHHRKIF-UHFFFAOYSA-N
MW206.03 g/mol
LogP1.72
Rot. Bonds2

About 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine

2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine (PubChem CID 155226394) has the molecular formula C6H5Cl2N3O and a molecular weight of 206.03 g/mol. Its IUPAC name is 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine
PubChem CID155226394
Molecular FormulaC6H5Cl2N3O
Molecular Weight206.03 g/mol
Exact Mass204.98
IUPAC Name2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine
SMILESClc1nc(Cl)nc(OC2CC2)n1
InChIInChI=1S/C6H5Cl2N3O/c7-4-9-5(8)11-6(10-4)12-3-1-2-3/h3H,1-2H2
InChIKeyBVXPRJRAHHRKIF-UHFFFAOYSA-N
XLogP1.72
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.03
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine (CID 155226394) is 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine is Clc1nc(Cl)nc(OC2CC2)n1.
What is the InChIKey of 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine?
The InChIKey is BVXPRJRAHHRKIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2N3O/c7-4-9-5(8)11-6(10-4)12-3-1-2-3/h3H,1-2H2.
What are the key properties of 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine?
2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine has a molecular weight of 206.03 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-cyclopropyloxy-1,3,5-triazine is sourced from PubChem (CID 155226394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).