2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol

C14H25N5O — CID 102640233

IUPAC2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
SMILESCC(C)c1nc(NN)cc(N(C)C2CCCCC2O)n1
InChIInChI=1S/C14H25N5O/c1-9(2)14-16-12(18-15)8-13(17-14)19(3)10-6-4-5-7-11(10)20/h8-11,20H,4-7,15H2,1-3H3,(H,16,17,18)
InChIKeyUQPFFTQIAGLKCY-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.63
Rot. Bonds4

About 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol

2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol (PubChem CID 102640233) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
PubChem CID102640233
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
SMILESCC(C)c1nc(NN)cc(N(C)C2CCCCC2O)n1
InChIInChI=1S/C14H25N5O/c1-9(2)14-16-12(18-15)8-13(17-14)19(3)10-6-4-5-7-11(10)20/h8-11,20H,4-7,15H2,1-3H3,(H,16,17,18)
InChIKeyUQPFFTQIAGLKCY-UHFFFAOYSA-N
XLogP1.63
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.63
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

N-cyclopentyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80968637
2-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640212
N-(4,4-dimethylcyclohexyl)-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80968908
N-cyclopentyl-6-hydrazinyl-N-(2-methylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 80968904
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 105421058
2-[[2-amino-6-(propylamino)pyrimidin-4-yl]-methylamino]cyclohexan-1-ol
CID 102640144
4-N-cycloheptyl-6-hydrazinyl-4-N-methylpyrimidine-2,4-diamine
CID 80899128
N-cyclooctyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968823
2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]-N-propan-2-ylacetamide
CID 80964094
2-[methyl-[6-(methylamino)-2-methylsulfanylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 102640099
N-cyclopropyl-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 80968411
N-butyl-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80969280

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol (CID 102640233) is 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol is CC(C)c1nc(NN)cc(N(C)C2CCCCC2O)n1.
What is the InChIKey of 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
The InChIKey is UQPFFTQIAGLKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-9(2)14-16-12(18-15)8-13(17-14)19(3)10-6-4-5-7-11(10)20/h8-11,20H,4-7,15H2,1-3H3,(H,16,17,18).
What are the key properties of 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol?
2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol has a molecular weight of 279.39 g/mol, XLogP of 1.63, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102640233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).