4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine

C10H15N7O — CID 80922318

IUPAC4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine
SMILESCc1nn(C)c(C)c1Oc1cc(NN)nc(N)n1
InChIInChI=1S/C10H15N7O/c1-5-9(6(2)17(3)16-5)18-8-4-7(15-12)13-10(11)14-8/h4H,12H2,1-3H3,(H3,11,13,14,15)
InChIKeyLQVQQGZPUIEODU-UHFFFAOYSA-N
MW249.28 g/mol
LogP0.49
Rot. Bonds3

About 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine

4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine (PubChem CID 80922318) has the molecular formula C10H15N7O and a molecular weight of 249.28 g/mol. Its IUPAC name is 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine
PubChem CID80922318
Molecular FormulaC10H15N7O
Molecular Weight249.28 g/mol
Exact Mass249.13
IUPAC Name4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine
SMILESCc1nn(C)c(C)c1Oc1cc(NN)nc(N)n1
InChIInChI=1S/C10H15N7O/c1-5-9(6(2)17(3)16-5)18-8-4-7(15-12)13-10(11)14-8/h4H,12H2,1-3H3,(H3,11,13,14,15)
InChIKeyLQVQQGZPUIEODU-UHFFFAOYSA-N
XLogP0.49
TPSA116.90 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.28
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-4-amine
CID 80941475
N-methyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-4-amine
CID 80878427
4-hydrazinyl-6-(3-methyl-4-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80915422
4-(5-chloro-2-methylphenoxy)-6-hydrazinylpyrimidin-2-amine
CID 80921660
4-(2-chloro-4-methylphenoxy)-6-hydrazinylpyrimidin-2-amine
CID 80930868
4-(5-bromo-2-methylphenoxy)-6-hydrazinylpyrimidin-2-amine
CID 107287670
4-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-6-hydrazinylpyrimidin-2-amine
CID 80912189
4-(3,5-dichlorophenoxy)-1,3,5-trimethylpyrazole
CID 58077329
2-chloro-6-(1,3,5-trimethylpyrazol-4-yl)oxypyridine-4-carbonitrile
CID 83072758
3-methyl-5-(1,3,5-trimethylpyrazol-4-yl)oxyaniline
CID 112648512
4-hydrazinyl-6-naphthalen-1-yloxypyrimidin-2-amine
CID 80916183
3-methoxy-5-(1,3,5-trimethylpyrazol-4-yl)oxyaniline
CID 80748204

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine?
The IUPAC name of 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine (CID 80922318) is 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine.
What is the SMILES notation for 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine?
The canonical SMILES for 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine is Cc1nn(C)c(C)c1Oc1cc(NN)nc(N)n1.
What is the InChIKey of 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine?
The InChIKey is LQVQQGZPUIEODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N7O/c1-5-9(6(2)17(3)16-5)18-8-4-7(15-12)13-10(11)14-8/h4H,12H2,1-3H3,(H3,11,13,14,15).
What are the key properties of 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine?
4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine has a molecular weight of 249.28 g/mol, XLogP of 0.49, 3 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-2-amine is sourced from PubChem (CID 80922318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).