4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one

C18H24N8O2 — CID 123522107

IUPAC4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one
SMILESO=C1NC(O)N=C1Cc1cnn2c(NC3CC3)nc(NC3CCCCC3)nc12
InChIInChI=1S/C18H24N8O2/c27-15-13(22-18(28)24-15)8-10-9-19-26-14(10)23-16(20-11-4-2-1-3-5-11)25-17(26)21-12-6-7-12/h9,11-12,18,28H,1-8H2,(H,24,27)(H2,20,21,23,25)
InChIKeySVQTZTWWRDKZER-UHFFFAOYSA-N
MW384.44 g/mol
LogP0.83
Rot. Bonds6

About 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one

4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one (PubChem CID 123522107) has the molecular formula C18H24N8O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one
PubChem CID123522107
Molecular FormulaC18H24N8O2
Molecular Weight384.44 g/mol
Exact Mass384.20
IUPAC Name4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one
SMILESO=C1NC(O)N=C1Cc1cnn2c(NC3CC3)nc(NC3CCCCC3)nc12
InChIInChI=1S/C18H24N8O2/c27-15-13(22-18(28)24-15)8-10-9-19-26-14(10)23-16(20-11-4-2-1-3-5-11)25-17(26)21-12-6-7-12/h9,11-12,18,28H,1-8H2,(H,24,27)(H2,20,21,23,25)
InChIKeySVQTZTWWRDKZER-UHFFFAOYSA-N
XLogP0.83
TPSA128.83 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 50.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

Analyze 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one with MolForge

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Related Compounds

N-hydroxy-3-[2-methyl-4-(methylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]propanamide
CID 10399844
N-methyl-3-[2-methyl-4-(methylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]propanamide
CID 69867698
N-hydroxy-3-[4-(methylamino)-2-propylpyrazolo[1,5-a][1,3,5]triazin-8-yl]propanamide
CID 90956787
1-Tert-butyl-3-[7-(cyclopropylamino)-3-[(2-hydroxy-5-oxo-1,2-dihydroimidazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]urea
CID 123215714
N-[4-[[4-(cyclopropylamino)-8-[(5-oxoimidazolidin-4-yl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]cyclohexyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 123235125
4-[[7-(Cyclopropylamino)-5-(2,6-dimethylmorpholin-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methyl]-1,2-dihydroimidazol-5-one
CID 123304500
1-But-3-en-2-yl-3-[7-(cyclopropylamino)-3-[(2-hydroxy-5-oxo-1,2-dihydroimidazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-5-yl]urea
CID 123403324
4-[4-(Cyclopropylamino)-2-methylpyrazolo[1,5-a][1,3,5]triazin-8-yl]-3-iminobutan-2-one
CID 123507324
4-[[4-(cyclopropylamino)-2-(oxan-4-yloxy)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-2-methyl-1H-imidazol-5-one
CID 123584562
4-[[4-(Cyclopropylamino)-2-methylpyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one
CID 123654827
N-[4-[[4-(cyclobutylamino)-8-[(2-hydroxy-5-oxo-1,2-dihydroimidazol-4-yl)methyl]pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino]cyclohexyl]-2-pyrrolidin-1-ylpropanamide
CID 123658229
4-[[4-(Cyclopropylamino)-2-(pyrrolidin-1-ylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one
CID 123658704

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one?
The IUPAC name of 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one (CID 123522107) is 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one.
What is the SMILES notation for 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one?
The canonical SMILES for 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one is O=C1NC(O)N=C1Cc1cnn2c(NC3CC3)nc(NC3CCCCC3)nc12.
What is the InChIKey of 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one?
The InChIKey is SVQTZTWWRDKZER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N8O2/c27-15-13(22-18(28)24-15)8-10-9-19-26-14(10)23-16(20-11-4-2-1-3-5-11)25-17(26)21-12-6-7-12/h9,11-12,18,28H,1-8H2,(H,24,27)(H2,20,21,23,25).
What are the key properties of 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one?
4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one has a molecular weight of 384.44 g/mol, XLogP of 0.83, 6 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(cyclohexylamino)-4-(cyclopropylamino)pyrazolo[1,5-a][1,3,5]triazin-8-yl]methyl]-2-hydroxy-1,2-dihydroimidazol-5-one is sourced from PubChem (CID 123522107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).