4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine

C11H9Cl2N5 — CID 79781008

IUPAC4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine
SMILESNc1nc(-c2ncc(Cl)cc2Cl)nc(C2CC2)n1
InChIInChI=1S/C11H9Cl2N5/c12-6-3-7(13)8(15-4-6)10-16-9(5-1-2-5)17-11(14)18-10/h3-5H,1-2H2,(H2,14,16,17,18)
InChIKeyRDXLOEPAAPWHBU-UHFFFAOYSA-N
MW282.13 g/mol
LogP2.70
Rot. Bonds2

About 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine

4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine (PubChem CID 79781008) has the molecular formula C11H9Cl2N5 and a molecular weight of 282.13 g/mol. Its IUPAC name is 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine
PubChem CID79781008
Molecular FormulaC11H9Cl2N5
Molecular Weight282.13 g/mol
Exact Mass281.02
IUPAC Name4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine
SMILESNc1nc(-c2ncc(Cl)cc2Cl)nc(C2CC2)n1
InChIInChI=1S/C11H9Cl2N5/c12-6-3-7(13)8(15-4-6)10-16-9(5-1-2-5)17-11(14)18-10/h3-5H,1-2H2,(H2,14,16,17,18)
InChIKeyRDXLOEPAAPWHBU-UHFFFAOYSA-N
XLogP2.70
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.13
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-cyclohexyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine
CID 79781409
2-(3,5-dichloro-2-pyridinyl)pyrimidin-5-amine
CID 79786246
6-cyclopropyl-2-(3,5-dichloro-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 79784106
4-(4-chlorophenyl)-6-cyclopentyl-1,3,5-triazin-2-amine
CID 63868356
2-(3,5-dichloro-2-pyridinyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 79780012
[2-(3,5-dichloro-2-pyridinyl)pyrimidin-4-yl]hydrazine
CID 79780757
2-(3,5-dichloro-2-pyridinyl)-5-iodo-6-propan-2-ylpyrimidin-4-amine
CID 79780014
4-cyclopropyl-6-(3-fluorophenyl)-1,3,5-triazin-2-amine
CID 63868480
5-bromo-4-chloro-2-(3,5-dichloro-2-pyridinyl)-6-methylpyrimidine
CID 79786506
3-chloro-2-[3-(3,5-dichloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline
CID 79783075
2-[[3-(3,5-dichloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]cyclohexan-1-amine
CID 106483527
4-cyclopropyl-6-(4-methylsulfanylphenyl)-1,3,5-triazin-2-amine
CID 106850121

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine (CID 79781008) is 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine is Nc1nc(-c2ncc(Cl)cc2Cl)nc(C2CC2)n1.
What is the InChIKey of 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine?
The InChIKey is RDXLOEPAAPWHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N5/c12-6-3-7(13)8(15-4-6)10-16-9(5-1-2-5)17-11(14)18-10/h3-5H,1-2H2,(H2,14,16,17,18).
What are the key properties of 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine?
4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine has a molecular weight of 282.13 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-(3,5-dichloro-2-pyridinyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 79781008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).