2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol

C11H19N5O2 — CID 80965192

IUPAC2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESNNc1cc(N(CCO)CCO)nc(C2CC2)n1
InChIInChI=1S/C11H19N5O2/c12-15-9-7-10(16(3-5-17)4-6-18)14-11(13-9)8-1-2-8/h7-8,17-18H,1-6,12H2,(H,13,14,15)
InChIKeyUYZMLTXMISEAQP-UHFFFAOYSA-N
MW253.31 g/mol
LogP-0.57
Rot. Bonds7

About 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol

2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (PubChem CID 80965192) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
PubChem CID80965192
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC Name2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
SMILESNNc1cc(N(CCO)CCO)nc(C2CC2)n1
InChIInChI=1S/C11H19N5O2/c12-15-9-7-10(16(3-5-17)4-6-18)14-11(13-9)8-1-2-8/h7-8,17-18H,1-6,12H2,(H,13,14,15)
InChIKeyUYZMLTXMISEAQP-UHFFFAOYSA-N
XLogP-0.57
TPSA107.53 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 5-0.57
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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Frequently Asked Questions

What is the IUPAC name of 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol (CID 80965192) is 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is NNc1cc(N(CCO)CCO)nc(C2CC2)n1.
What is the InChIKey of 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
The InChIKey is UYZMLTXMISEAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c12-15-9-7-10(16(3-5-17)4-6-18)14-11(13-9)8-1-2-8/h7-8,17-18H,1-6,12H2,(H,13,14,15).
What are the key properties of 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol?
2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol has a molecular weight of 253.31 g/mol, XLogP of -0.57, 7 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 80965192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).