[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine

C9H16N4O — CID 65092426

IUPAC[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine
SMILESCOCCCc1nc(C)cc(NN)n1
InChIInChI=1S/C9H16N4O/c1-7-6-9(13-10)12-8(11-7)4-3-5-14-2/h6H,3-5,10H2,1-2H3,(H,11,12,13)
InChIKeyZXCCDFNHISYMTR-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.65
Rot. Bonds5

About [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine

[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine (PubChem CID 65092426) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine
PubChem CID65092426
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine
SMILESCOCCCc1nc(C)cc(NN)n1
InChIInChI=1S/C9H16N4O/c1-7-6-9(13-10)12-8(11-7)4-3-5-14-2/h6H,3-5,10H2,1-2H3,(H,11,12,13)
InChIKeyZXCCDFNHISYMTR-UHFFFAOYSA-N
XLogP0.65
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine (CID 65092426) is [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine is COCCCc1nc(C)cc(NN)n1.
What is the InChIKey of [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine?
The InChIKey is ZXCCDFNHISYMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-7-6-9(13-10)12-8(11-7)4-3-5-14-2/h6H,3-5,10H2,1-2H3,(H,11,12,13).
What are the key properties of [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine?
[2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine has a molecular weight of 196.25 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxypropyl)-6-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 65092426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).