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'}

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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).