2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol

C15H27N5O — CID 81000782

IUPAC2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESCCCc1nc(NN)c(C)c(N2CCCCC2CCO)n1
InChIInChI=1S/C15H27N5O/c1-3-6-13-17-14(19-16)11(2)15(18-13)20-9-5-4-7-12(20)8-10-21/h12,21H,3-10,16H2,1-2H3,(H,17,18,19)
InChIKeyYWVYBMVBCJPRLJ-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.76
Rot. Bonds6

About 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol

2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol (PubChem CID 81000782) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol
PubChem CID81000782
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESCCCc1nc(NN)c(C)c(N2CCCCC2CCO)n1
InChIInChI=1S/C15H27N5O/c1-3-6-13-17-14(19-16)11(2)15(18-13)20-9-5-4-7-12(20)8-10-21/h12,21H,3-10,16H2,1-2H3,(H,17,18,19)
InChIKeyYWVYBMVBCJPRLJ-UHFFFAOYSA-N
XLogP1.76
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 51.76
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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Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol (CID 81000782) is 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol is CCCc1nc(NN)c(C)c(N2CCCCC2CCO)n1.
What is the InChIKey of 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol?
The InChIKey is YWVYBMVBCJPRLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-3-6-13-17-14(19-16)11(2)15(18-13)20-9-5-4-7-12(20)8-10-21/h12,21H,3-10,16H2,1-2H3,(H,17,18,19).
What are the key properties of 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol?
2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol has a molecular weight of 293.42 g/mol, XLogP of 1.76, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)piperidin-2-yl]ethanol is sourced from PubChem (CID 81000782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).