4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine

C7H8Cl2N4 — CID 62868732

IUPAC4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine
SMILESClc1nc(Cl)nc(NC2CCC2)n1
InChIInChI=1S/C7H8Cl2N4/c8-5-11-6(9)13-7(12-5)10-4-2-1-3-4/h4H,1-3H2,(H,10,11,12,13)
InChIKeyFOHMICLOGACUFC-UHFFFAOYSA-N
MW219.07 g/mol
LogP2.14
Rot. Bonds2

About 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine

4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine (PubChem CID 62868732) has the molecular formula C7H8Cl2N4 and a molecular weight of 219.07 g/mol. Its IUPAC name is 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine
PubChem CID62868732
Molecular FormulaC7H8Cl2N4
Molecular Weight219.07 g/mol
Exact Mass218.01
IUPAC Name4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine
SMILESClc1nc(Cl)nc(NC2CCC2)n1
InChIInChI=1S/C7H8Cl2N4/c8-5-11-6(9)13-7(12-5)10-4-2-1-3-4/h4H,1-3H2,(H,10,11,12,13)
InChIKeyFOHMICLOGACUFC-UHFFFAOYSA-N
XLogP2.14
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.07
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dichloro-N-cyclopropyl-1,3,5-triazin-2-amine
CID 22254066
6-chloro-2-N-cyclobutyl-1,3,5-triazine-2,4-diamine
CID 80827381
6-chloro-2-N-cyclopentyl-1,3,5-triazine-2,4-diamine
CID 11970858
4,6-dichloro-N-(oxan-4-yl)-1,3,5-triazin-2-amine
CID 62868886
4-chloro-N,6-di(cycloundecyl)-1,3,5-triazin-2-amine
CID 167222890
6-chloro-2-N-cyclobutyl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80827269
4,6-dichloro-N-(3-ethylcyclohexyl)-1,3,5-triazin-2-amine
CID 64744122
4-chloro-N-cycloheptyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 62870590
6-chloro-2-N-cyclopentyl-4-N-(3,5-dichlorophenyl)-1,3,5-triazine-2,4-diamine
CID 44627401
4,6-dichloro-N-(thiolan-3-yl)-1,3,5-triazin-2-amine
CID 103064279
4-chloro-N-cyclopentyl-6-propoxy-1,3,5-triazin-2-amine
CID 55124107
6-chloro-4-N-(4-chlorophenyl)-2-N-cyclohexyl-1,3,5-triazine-2,4-diamine
CID 758948

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine (CID 62868732) is 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine is Clc1nc(Cl)nc(NC2CCC2)n1.
What is the InChIKey of 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine?
The InChIKey is FOHMICLOGACUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Cl2N4/c8-5-11-6(9)13-7(12-5)10-4-2-1-3-4/h4H,1-3H2,(H,10,11,12,13).
What are the key properties of 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine?
4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine has a molecular weight of 219.07 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N-cyclobutyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 62868732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).