2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol

C11H20N6O — CID 80927450

IUPAC2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESNNc1cc(N2CCCCC2CCO)nc(N)n1
InChIInChI=1S/C11H20N6O/c12-11-14-9(16-13)7-10(15-11)17-5-2-1-3-8(17)4-6-18/h7-8,18H,1-6,13H2,(H3,12,14,15,16)
InChIKeyIVTVQRHXYHWJJL-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.09
Rot. Bonds4

About 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol

2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol (PubChem CID 80927450) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol
PubChem CID80927450
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESNNc1cc(N2CCCCC2CCO)nc(N)n1
InChIInChI=1S/C11H20N6O/c12-11-14-9(16-13)7-10(15-11)17-5-2-1-3-8(17)4-6-18/h7-8,18H,1-6,13H2,(H3,12,14,15,16)
InChIKeyIVTVQRHXYHWJJL-UHFFFAOYSA-N
XLogP0.09
TPSA113.32 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

4-hydrazinyl-6-(2-propylpiperidin-1-yl)pyrimidin-2-amine
CID 83057547
2-[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]piperidin-2-yl]ethanol
CID 80767376
2-[1-(6-hydrazinyl-2-pyridinyl)piperidin-2-yl]ethanol
CID 80928543
1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80904574
3-[1-(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)pyrrolidin-2-yl]propan-1-ol
CID 80964581
[1-[2-amino-6-(ethylamino)pyrimidin-4-yl]azepan-2-yl]methanol
CID 116640645
[2-cyclopropyl-6-(2-propylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 83056734
2-[1-(4-amino-6-chloro-2-pyridinyl)piperidin-2-yl]ethanol
CID 114070518
[(2R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 122491334
[1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)azepan-2-yl]methanol
CID 116640797
3-[1-(2-tert-butyl-6-hydrazinylpyrimidin-4-yl)pyrrolidin-2-yl]propan-1-ol
CID 80964573
3-[1-(2,6-diaminopyrimidin-4-yl)pyrrolidin-2-yl]propan-1-ol
CID 80827064

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol (CID 80927450) is 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol is NNc1cc(N2CCCCC2CCO)nc(N)n1.
What is the InChIKey of 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The InChIKey is IVTVQRHXYHWJJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c12-11-14-9(16-13)7-10(15-11)17-5-2-1-3-8(17)4-6-18/h7-8,18H,1-6,13H2,(H3,12,14,15,16).
What are the key properties of 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol?
2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol has a molecular weight of 252.32 g/mol, XLogP of 0.09, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-2-yl]ethanol is sourced from PubChem (CID 80927450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).