[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol

C13H24N6O — CID 80833108

IUPAC[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol
SMILESCC1CCC(CO)(Nc2nc(N)nc(N(C)C)n2)CC1
InChIInChI=1S/C13H24N6O/c1-9-4-6-13(8-20,7-5-9)18-11-15-10(14)16-12(17-11)19(2)3/h9,20H,4-8H2,1-3H3,(H3,14,15,16,17,18)
InChIKeyQUDFKGKXURQBIB-UHFFFAOYSA-N
MW280.38 g/mol
LogP0.87
Rot. Bonds4

About [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol

[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol (PubChem CID 80833108) has the molecular formula C13H24N6O and a molecular weight of 280.38 g/mol. Its IUPAC name is [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol
PubChem CID80833108
Molecular FormulaC13H24N6O
Molecular Weight280.38 g/mol
Exact Mass280.20
IUPAC Name[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol
SMILESCC1CCC(CO)(Nc2nc(N)nc(N(C)C)n2)CC1
InChIInChI=1S/C13H24N6O/c1-9-4-6-13(8-20,7-5-9)18-11-15-10(14)16-12(17-11)19(2)3/h9,20H,4-8H2,1-3H3,(H3,14,15,16,17,18)
InChIKeyQUDFKGKXURQBIB-UHFFFAOYSA-N
XLogP0.87
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol with MolForge

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Related Compounds

[1-[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol
CID 80832899
[1-[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]-4-methylcyclohexyl]methanol
CID 80803602
[1-[(2-hydrazinylpyrimidin-4-yl)amino]-4-methylcyclohexyl]methanol
CID 80918902
[1-[(3-amino-6-methyl-2-pyridinyl)amino]-4-methylcyclohexyl]methanol
CID 81132451
[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
CID 106368117
[1-[(3-amino-6-chloro-2-pyridinyl)amino]-4-methylcyclohexyl]methanol
CID 115474089
1-[[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]methyl]cycloheptan-1-ol
CID 80843227
[4-methyl-1-[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)amino]cyclohexyl]methanol
CID 115974963
[4-methyl-1-(quinazolin-2-ylamino)cyclohexyl]methanol
CID 114789059
[1-[(6-chloro-2-cyclopropylpyrimidin-4-yl)amino]-4-methylcyclohexyl]methanol
CID 80951495
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol
CID 107868692
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-2-ethylbutan-1-ol
CID 80831979

Frequently Asked Questions

What is the IUPAC name of [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol?
The IUPAC name of [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol (CID 80833108) is [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol.
What is the SMILES notation for [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol?
The canonical SMILES for [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol is CC1CCC(CO)(Nc2nc(N)nc(N(C)C)n2)CC1.
What is the InChIKey of [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol?
The InChIKey is QUDFKGKXURQBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6O/c1-9-4-6-13(8-20,7-5-9)18-11-15-10(14)16-12(17-11)19(2)3/h9,20H,4-8H2,1-3H3,(H3,14,15,16,17,18).
What are the key properties of [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol?
[1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol has a molecular weight of 280.38 g/mol, XLogP of 0.87, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methylcyclohexyl]methanol is sourced from PubChem (CID 80833108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).