[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine

C13H16N4O2 — CID 62250716

IUPAC[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine
SMILESCOc1ccc(-c2nc(C)cc(NN)n2)c(OC)c1
InChIInChI=1S/C13H16N4O2/c1-8-6-12(17-14)16-13(15-8)10-5-4-9(18-2)7-11(10)19-3/h4-7H,14H2,1-3H3,(H,15,16,17)
InChIKeyVAMGHSVAIPISGO-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.75
Rot. Bonds4

About [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine

[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine (PubChem CID 62250716) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine
PubChem CID62250716
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine
SMILESCOc1ccc(-c2nc(C)cc(NN)n2)c(OC)c1
InChIInChI=1S/C13H16N4O2/c1-8-6-12(17-14)16-13(15-8)10-5-4-9(18-2)7-11(10)19-3/h4-7H,14H2,1-3H3,(H,15,16,17)
InChIKeyVAMGHSVAIPISGO-UHFFFAOYSA-N
XLogP1.75
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine (CID 62250716) is [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine is COc1ccc(-c2nc(C)cc(NN)n2)c(OC)c1.
What is the InChIKey of [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine?
The InChIKey is VAMGHSVAIPISGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-8-6-12(17-14)16-13(15-8)10-5-4-9(18-2)7-11(10)19-3/h4-7H,14H2,1-3H3,(H,15,16,17).
What are the key properties of [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine?
[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine has a molecular weight of 260.30 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62250716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).