4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

C12H18N6O2 — CID 81346559

IUPAC4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCNc1nc(Oc2cc(C)nn2C)nc(OC(C)C)n1
InChIInChI=1S/C12H18N6O2/c1-7(2)19-11-14-10(13-4)15-12(16-11)20-9-6-8(3)17-18(9)5/h6-7H,1-5H3,(H,13,14,15,16)
InChIKeyWQDUPEDGEWHONN-UHFFFAOYSA-N
MW278.32 g/mol
LogP1.53
Rot. Bonds5

About 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 81346559) has the molecular formula C12H18N6O2 and a molecular weight of 278.32 g/mol. Its IUPAC name is 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID81346559
Molecular FormulaC12H18N6O2
Molecular Weight278.32 g/mol
Exact Mass278.15
IUPAC Name4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCNc1nc(Oc2cc(C)nn2C)nc(OC(C)C)n1
InChIInChI=1S/C12H18N6O2/c1-7(2)19-11-14-10(13-4)15-12(16-11)20-9-6-8(3)17-18(9)5/h6-7H,1-5H3,(H,13,14,15,16)
InChIKeyWQDUPEDGEWHONN-UHFFFAOYSA-N
XLogP1.53
TPSA86.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-(2,5-dimethylpyrazol-3-yl)oxy-5-fluoro-N-methylpyrimidin-2-amine
CID 81345946
4-(2,4-dibromophenoxy)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80871301
4-(1-methoxypropan-2-yloxy)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80880228
3,5-dichloro-6-(2,5-dimethylpyrazol-3-yl)oxy-N-methylpyridin-2-amine
CID 102761085
N-methyl-4-[(1-methylimidazol-2-yl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 79738564
2-(2,5-dimethylpyrazol-3-yl)oxy-6-methylpyrimidine-4-carbothioamide
CID 107548691
N-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 115943139
4-but-3-enoxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80861655
4-N-methyl-2-N-[(1-methylcyclopropyl)methyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 114102497
N-methyl-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106928501
2-N-(2-fluoro-4-methylphenyl)-4-N-methyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80729258
4-butyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 106659350

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 81346559) is 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is CNc1nc(Oc2cc(C)nn2C)nc(OC(C)C)n1.
What is the InChIKey of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is WQDUPEDGEWHONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O2/c1-7(2)19-11-14-10(13-4)15-12(16-11)20-9-6-8(3)17-18(9)5/h6-7H,1-5H3,(H,13,14,15,16).
What are the key properties of 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 278.32 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylpyrazol-3-yl)oxy-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 81346559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).