3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol

C14H26N4O — CID 106544559

IUPAC3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol
SMILESCCCC(CCO)CNc1nnc(CC)c(CC)n1
InChIInChI=1S/C14H26N4O/c1-4-7-11(8-9-19)10-15-14-16-12(5-2)13(6-3)17-18-14/h11,19H,4-10H2,1-3H3,(H,15,16,18)
InChIKeyHVNYYJILBNKDPR-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.21
Rot. Bonds9

About 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol

3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol (PubChem CID 106544559) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol.

Molecular Properties

Compound Name3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol
PubChem CID106544559
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol
SMILESCCCC(CCO)CNc1nnc(CC)c(CC)n1
InChIInChI=1S/C14H26N4O/c1-4-7-11(8-9-19)10-15-14-16-12(5-2)13(6-3)17-18-14/h11,19H,4-10H2,1-3H3,(H,15,16,18)
InChIKeyHVNYYJILBNKDPR-UHFFFAOYSA-N
XLogP2.21
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol with MolForge

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Related Compounds

N-[2-(2-chloroethyl)pentyl]-5,6-diethyl-1,2,4-triazin-3-amine
CID 114145656
3-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol
CID 104924549
3-[[(4-methylpyrimidin-2-yl)amino]methyl]hexan-1-ol
CID 103705117
3-[[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]methyl]hexan-1-ol
CID 106118510
1-N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-methylpentane-1,2-diamine
CID 107159279
3-[[(4,6-dimethoxypyrimidin-2-yl)amino]methyl]hexan-1-ol
CID 106115742
1-N-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,3-diamine
CID 105362989
3-[[[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]hexan-1-ol
CID 106118553
3-[[(1-methyltetrazol-5-yl)amino]methyl]hexan-1-ol
CID 103705100
3-[[(4-amino-6-methoxy-1,3,5-triazin-2-yl)amino]methyl]hexan-1-ol
CID 114145921
3-[[(6-ethyl-5-fluoropyrimidin-4-yl)amino]methyl]hexan-1-ol
CID 113344426
5,6-diethyl-N-(2-methylprop-2-enyl)-1,2,4-triazin-3-amine
CID 105362879

Frequently Asked Questions

What is the IUPAC name of 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol?
The IUPAC name of 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol (CID 106544559) is 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol.
What is the SMILES notation for 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol?
The canonical SMILES for 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol is CCCC(CCO)CNc1nnc(CC)c(CC)n1.
What is the InChIKey of 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol?
The InChIKey is HVNYYJILBNKDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-7-11(8-9-19)10-15-14-16-12(5-2)13(6-3)17-18-14/h11,19H,4-10H2,1-3H3,(H,15,16,18).
What are the key properties of 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol?
3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol has a molecular weight of 266.39 g/mol, XLogP of 2.21, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(5,6-diethyl-1,2,4-triazin-3-yl)amino]methyl]hexan-1-ol is sourced from PubChem (CID 106544559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).