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

C9H16N6O — CID 80913955

IUPAC2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol
SMILESNNc1cc(NCC(O)C2CC2)nc(N)n1
InChIInChI=1S/C9H16N6O/c10-9-13-7(3-8(14-9)15-11)12-4-6(16)5-1-2-5/h3,5-6,16H,1-2,4,11H2,(H4,10,12,13,14,15)
InChIKeyRCJFXPBUVNHXMA-UHFFFAOYSA-N
MW224.27 g/mol
LogP-0.47
Rot. Bonds5

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

2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol (PubChem CID 80913955) has the molecular formula C9H16N6O and a molecular weight of 224.27 g/mol. Its IUPAC name is 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol.

Molecular Properties

Compound Name2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol
PubChem CID80913955
Molecular FormulaC9H16N6O
Molecular Weight224.27 g/mol
Exact Mass224.14
IUPAC Name2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol
SMILESNNc1cc(NCC(O)C2CC2)nc(N)n1
InChIInChI=1S/C9H16N6O/c10-9-13-7(3-8(14-9)15-11)12-4-6(16)5-1-2-5/h3,5-6,16H,1-2,4,11H2,(H4,10,12,13,14,15)
InChIKeyRCJFXPBUVNHXMA-UHFFFAOYSA-N
XLogP-0.47
TPSA122.11 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 5-0.47
H-Bond Donors ≤ 55
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

1-cyclopropyl-2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethanol
CID 80937078
2-[(4-amino-6-chloro-2-pyridinyl)amino]-1-cyclopropylethanol
CID 104924180
1-cyclopropyl-2-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethanol
CID 80958153
3-[[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]methyl]pentan-1-ol
CID 80926110
6-hydrazinyl-4-N-[(3-methylcyclopentyl)methyl]pyrimidine-2,4-diamine
CID 107416016
6-chloro-4-N-(2-cyclopropylpropyl)pyrimidine-2,4-diamine
CID 115591456
1-cyclopropyl-2-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]ethanol
CID 80913877
4-[(2-cyclopropyl-2-hydroxyethyl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136975670
2-[(2-chloro-1,3-thiazol-4-yl)amino]-1-cyclopropylethanol
CID 130678424
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80910192
6-hydrazinyl-4-N-(thian-2-ylmethyl)pyrimidine-2,4-diamine
CID 80926536
3-[[2-amino-6-(propylamino)pyrimidin-4-yl]amino]propane-1,2-diol
CID 80850604

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol?
The IUPAC name of 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol (CID 80913955) is 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol.
What is the SMILES notation for 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol?
The canonical SMILES for 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol is NNc1cc(NCC(O)C2CC2)nc(N)n1.
What is the InChIKey of 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol?
The InChIKey is RCJFXPBUVNHXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6O/c10-9-13-7(3-8(14-9)15-11)12-4-6(16)5-1-2-5/h3,5-6,16H,1-2,4,11H2,(H4,10,12,13,14,15).
What are the key properties of 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol?
2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol has a molecular weight of 224.27 g/mol, XLogP of -0.47, 5 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-6-hydrazinylpyrimidin-4-yl)amino]-1-cyclopropylethanol is sourced from PubChem (CID 80913955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).