[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine

C9H14N4O — CID 114471277

IUPAC[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine
SMILESC=C(C)CCOc1cc(NN)ncn1
InChIInChI=1S/C9H14N4O/c1-7(2)3-4-14-9-5-8(13-10)11-6-12-9/h5-6H,1,3-4,10H2,2H3,(H,11,12,13)
InChIKeyIGPYFDUYXINSCT-UHFFFAOYSA-N
MW194.24 g/mol
LogP1.11
Rot. Bonds5

About [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine

[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine (PubChem CID 114471277) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine
PubChem CID114471277
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine
SMILESC=C(C)CCOc1cc(NN)ncn1
InChIInChI=1S/C9H14N4O/c1-7(2)3-4-14-9-5-8(13-10)11-6-12-9/h5-6H,1,3-4,10H2,2H3,(H,11,12,13)
InChIKeyIGPYFDUYXINSCT-UHFFFAOYSA-N
XLogP1.11
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-(methoxymethyl)-6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine
CID 114471271
[6-(3-phenylpropoxy)pyrimidin-4-yl]hydrazine
CID 80931328
N-[2-(6-hydrazinylpyrimidin-4-yl)oxyethyl]-N-methylcyclopropanamine
CID 102741463
[4-(3-methylbut-3-enoxy)pyrimidin-2-yl]hydrazine
CID 114471298
[6-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]hydrazine
CID 80913517
[2-(3-methylbut-3-enoxy)-4-pyridinyl]methanamine
CID 114470522
2-cyclopropyl-N-ethyl-6-(3-methylbut-3-enoxy)pyrimidin-4-amine
CID 114471097
[6-(furan-2-ylmethoxy)pyrimidin-4-yl]hydrazine
CID 80908948
N-methyl-1-[6-(3-methylbut-3-enoxy)-2-pyridinyl]methanamine
CID 114470605
2-methyl-N-[[2-(3-methylbut-3-enoxy)-4-pyridinyl]methyl]propan-1-amine
CID 114470489
4-(3-methylbut-3-enoxy)-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566627
6-(3-methylbut-3-enoxy)pyridazine-3-carboxylic acid
CID 114469998

Frequently Asked Questions

What is the IUPAC name of [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine (CID 114471277) is [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine is C=C(C)CCOc1cc(NN)ncn1.
What is the InChIKey of [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is IGPYFDUYXINSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-7(2)3-4-14-9-5-8(13-10)11-6-12-9/h5-6H,1,3-4,10H2,2H3,(H,11,12,13).
What are the key properties of [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine?
[6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 194.24 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methylbut-3-enoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 114471277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).