N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine

C11H20N4O2 — CID 62859814

IUPACN-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCCCC(CC)Nc1nc(OC)nc(OC)n1
InChIInChI=1S/C11H20N4O2/c1-5-7-8(6-2)12-9-13-10(16-3)15-11(14-9)17-4/h8H,5-7H2,1-4H3,(H,12,13,14,15)
InChIKeyYIDQLRYRQOJOHS-UHFFFAOYSA-N
MW240.31 g/mol
LogP1.88
Rot. Bonds7

About N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine

N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine (PubChem CID 62859814) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine
PubChem CID62859814
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC NameN-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCCCC(CC)Nc1nc(OC)nc(OC)n1
InChIInChI=1S/C11H20N4O2/c1-5-7-8(6-2)12-9-13-10(16-3)15-11(14-9)17-4/h8H,5-7H2,1-4H3,(H,12,13,14,15)
InChIKeyYIDQLRYRQOJOHS-UHFFFAOYSA-N
XLogP1.88
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-hexan-3-yl-4-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80818293
4,6-dichloro-N-hexan-3-yl-1,3,5-triazin-2-amine
CID 62869584
N-hexan-3-yl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80907736
6-ethoxy-2-N-hexan-3-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80817723
4-chloro-6-methoxy-N-pentan-2-yl-1,3,5-triazin-2-amine
CID 62859139
3-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)butane-1,3-diamine
CID 83178530
4,6-dimethoxy-N-pent-4-yn-2-yl-1,3,5-triazin-2-amine
CID 115658924
3-methoxy-2-[[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 106198781
N-hexan-3-yl-4-methyl-6-propoxypyrimidin-2-amine
CID 112637434
N-(1-cyclohexylpropyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 63541208
6-tert-butyl-2-N-hexan-3-yl-1,3,5-triazine-2,4-diamine
CID 112746179
2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)amino]propane-1,3-diol
CID 80842933

Frequently Asked Questions

What is the IUPAC name of N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine (CID 62859814) is N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine is CCCC(CC)Nc1nc(OC)nc(OC)n1.
What is the InChIKey of N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine?
The InChIKey is YIDQLRYRQOJOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-5-7-8(6-2)12-9-13-10(16-3)15-11(14-9)17-4/h8H,5-7H2,1-4H3,(H,12,13,14,15).
What are the key properties of N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine?
N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine has a molecular weight of 240.31 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexan-3-yl-4,6-dimethoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 62859814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).