5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol

C11H21N5O — CID 106138738

IUPAC5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
SMILESCCc1c(NN)ncnc1NCCCC(C)O
InChIInChI=1S/C11H21N5O/c1-3-9-10(13-6-4-5-8(2)17)14-7-15-11(9)16-12/h7-8,17H,3-6,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyONGMYDMAMKLLGZ-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.90
Rot. Bonds7

About 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol

5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol (PubChem CID 106138738) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
PubChem CID106138738
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
SMILESCCc1c(NN)ncnc1NCCCC(C)O
InChIInChI=1S/C11H21N5O/c1-3-9-10(13-6-4-5-8(2)17)14-7-15-11(9)16-12/h7-8,17H,3-6,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyONGMYDMAMKLLGZ-UHFFFAOYSA-N
XLogP0.90
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.90
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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'}

Analyze 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol with MolForge

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Related Compounds

1-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]propan-2-ol
CID 80906559
5-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138739
5-[(5-bromo-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138742
4-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]butan-2-ol
CID 80841124
4-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-1-methoxybutan-2-ol
CID 106249039
5-[[5-methyl-6-(propylamino)pyrimidin-4-yl]amino]pentan-2-ol
CID 114148658
4-[(6-chloro-5-ethylpyrimidin-4-yl)amino]butan-2-ol
CID 64912142
5-[(6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138705
5-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138744
2-[2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 80918817
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106179504
N-(2-cyclopropylethyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80924360

Frequently Asked Questions

What is the IUPAC name of 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol?
The IUPAC name of 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol (CID 106138738) is 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol.
What is the SMILES notation for 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol?
The canonical SMILES for 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol is CCc1c(NN)ncnc1NCCCC(C)O.
What is the InChIKey of 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol?
The InChIKey is ONGMYDMAMKLLGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-3-9-10(13-6-4-5-8(2)17)14-7-15-11(9)16-12/h7-8,17H,3-6,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol?
5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol has a molecular weight of 239.32 g/mol, XLogP of 0.90, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]pentan-2-ol is sourced from PubChem (CID 106138738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).