1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol

C12H21N5O — CID 81006562

IUPAC1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol
SMILESCCc1nc(NN)c(C)c(NCC(O)C2CC2)n1
InChIInChI=1S/C12H21N5O/c1-3-10-15-11(7(2)12(16-10)17-13)14-6-9(18)8-4-5-8/h8-9,18H,3-6,13H2,1-2H3,(H2,14,15,16,17)
InChIKeySDRFMSPLHYVFNM-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.82
Rot. Bonds6

About 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol

1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol (PubChem CID 81006562) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol
PubChem CID81006562
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol
SMILESCCc1nc(NN)c(C)c(NCC(O)C2CC2)n1
InChIInChI=1S/C12H21N5O/c1-3-10-15-11(7(2)12(16-10)17-13)14-6-9(18)8-4-5-8/h8-9,18H,3-6,13H2,1-2H3,(H2,14,15,16,17)
InChIKeySDRFMSPLHYVFNM-UHFFFAOYSA-N
XLogP0.82
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.82
H-Bond Donors ≤ 54
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

1-cyclopropyl-2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethanol
CID 80937078
4-N-(2,2-dicyclopropylethyl)-2-ethyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80992371
5-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138744
2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 81007386
3-[(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propane-1,2-diol
CID 81006614
2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-1-cyclopropylethanol
CID 80984904
2-ethyl-N-[(1-ethylpiperidin-4-yl)methyl]-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 81007566
1-cyclopropyl-2-[[5-methyl-6-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80830309
6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81001135
2-ethyl-2-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]butan-1-ol
CID 106256710
2-[(6-chloro-4,5-dimethylpyridazin-3-yl)amino]-1-cyclopropylethanol
CID 63297547
[1-[[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103968794

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol (CID 81006562) is 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol is CCc1nc(NN)c(C)c(NCC(O)C2CC2)n1.
What is the InChIKey of 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol?
The InChIKey is SDRFMSPLHYVFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-3-10-15-11(7(2)12(16-10)17-13)14-6-9(18)8-4-5-8/h8-9,18H,3-6,13H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol?
1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol has a molecular weight of 251.33 g/mol, XLogP of 0.82, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 81006562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).