2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol

C8H14FN5O — CID 80898789

IUPAC2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol
SMILESCCN(CCO)c1nc(NN)ncc1F
InChIInChI=1S/C8H14FN5O/c1-2-14(3-4-15)7-6(9)5-11-8(12-7)13-10/h5,15H,2-4,10H2,1H3,(H,11,12,13)
InChIKeyRJXOHWNKQILPSN-UHFFFAOYSA-N
MW215.23 g/mol
LogP-0.28
Rot. Bonds5

About 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol

2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol (PubChem CID 80898789) has the molecular formula C8H14FN5O and a molecular weight of 215.23 g/mol. Its IUPAC name is 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol
PubChem CID80898789
Molecular FormulaC8H14FN5O
Molecular Weight215.23 g/mol
Exact Mass215.12
IUPAC Name2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol
SMILESCCN(CCO)c1nc(NN)ncc1F
InChIInChI=1S/C8H14FN5O/c1-2-14(3-4-15)7-6(9)5-11-8(12-7)13-10/h5,15H,2-4,10H2,1H3,(H,11,12,13)
InChIKeyRJXOHWNKQILPSN-UHFFFAOYSA-N
XLogP-0.28
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
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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Related Compounds

2-[(2-hydrazinyl-5-methylpyrimidin-4-yl)-propylamino]ethanol
CID 80896004
4-N,4-N-diethyl-5-fluoro-2-N-methylpyrimidine-2,4-diamine
CID 80767009
N-ethyl-5-fluoro-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 80896411
2-[(5-bromo-2-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
CID 80898903
2-[ethyl-[5-methyl-2-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80790817
2-[benzyl-[2-(ethylamino)-5-fluoropyrimidin-4-yl]amino]ethanol
CID 80798327
N-cyclopentyl-N-ethyl-5-fluoro-2-hydrazinylpyrimidin-4-amine
CID 80907560
N-ethyl-5-fluoro-2-hydrazinyl-N-(2-methylphenyl)pyrimidin-4-amine
CID 80916335
2-[ethyl-[5-methyl-2-(propylamino)pyrimidin-4-yl]amino]ethanol
CID 80790274
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]ethanol
CID 80899174
2-[[5-fluoro-2-(methylamino)pyrimidin-4-yl]-pentan-3-ylamino]ethanol
CID 80811048
2-[[2-(ethylamino)-5-fluoropyrimidin-4-yl]-propan-2-ylamino]ethanol
CID 80810772

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol (CID 80898789) is 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol is CCN(CCO)c1nc(NN)ncc1F.
What is the InChIKey of 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol?
The InChIKey is RJXOHWNKQILPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN5O/c1-2-14(3-4-15)7-6(9)5-11-8(12-7)13-10/h5,15H,2-4,10H2,1H3,(H,11,12,13).
What are the key properties of 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol?
2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol has a molecular weight of 215.23 g/mol, XLogP of -0.28, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(5-fluoro-2-hydrazinylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 80898789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).