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

C10H16Cl2N4 — CID 59781977

IUPAC4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine
SMILESCCCCCCN(C)c1nc(Cl)nc(Cl)n1
InChIInChI=1S/C10H16Cl2N4/c1-3-4-5-6-7-16(2)10-14-8(11)13-9(12)15-10/h3-7H2,1-2H3
InChIKeySLLIBFWRXYRNSA-UHFFFAOYSA-N
MW263.17 g/mol
LogP3.19
Rot. Bonds6

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

4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine (PubChem CID 59781977) has the molecular formula C10H16Cl2N4 and a molecular weight of 263.17 g/mol. Its IUPAC name is 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine
PubChem CID59781977
Molecular FormulaC10H16Cl2N4
Molecular Weight263.17 g/mol
Exact Mass262.08
IUPAC Name4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine
SMILESCCCCCCN(C)c1nc(Cl)nc(Cl)n1
InChIInChI=1S/C10H16Cl2N4/c1-3-4-5-6-7-16(2)10-14-8(11)13-9(12)15-10/h3-7H2,1-2H3
InChIKeySLLIBFWRXYRNSA-UHFFFAOYSA-N
XLogP3.19
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.17
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,4-Dichloro-6-(1-piperidinyl)-1,3,5-triazine
CID 209165
N,N,N',N'-tetramethyl-6-(1-piperidinyl)-1,3,5-triazine-2,4-diamine
CID 969866
1H-Azepine, 1-(4,6-dichloro-1,3,5-triazin-2-yl)hexahydro-
CID 3062483
N,N-dibutyl-4,6-dichloro-1,3,5-triazin-2-amine
CID 15355831
4,6-dichloro-N-dodecyl-1,3,5-triazin-2-amine
CID 33332
1,3,5-Triazine-2,4-diamine, N2,N2,N4,N4-tetrabutyl-6-chloro-
CID 3750346
4,6-dichloro-N-hexyl-1,3,5-triazin-2-amine
CID 12937544
4-chloro-N,N-diethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 14813048
2-Octylamino 4,6-dichloro-s-triazine
CID 3107864
4,6-dichloro-N,N-dicyclohexyl-1,3,5-triazin-2-amine
CID 20405726
4,6-dichloro-N-pentyl-1,3,5-triazin-2-amine
CID 21558474
2-N,4-N-dibutyl-6-chloro-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 53700990

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine (CID 59781977) is 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine is CCCCCCN(C)c1nc(Cl)nc(Cl)n1.
What is the InChIKey of 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is SLLIBFWRXYRNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Cl2N4/c1-3-4-5-6-7-16(2)10-14-8(11)13-9(12)15-10/h3-7H2,1-2H3.
What are the key properties of 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine?
4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 263.17 g/mol, XLogP of 3.19, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N-hexyl-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 59781977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).