1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol

C13H23N5O — CID 114684050

IUPAC1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol
SMILESCCCc1c(NN)ncnc1N1CCC(O)C(C)C1
InChIInChI=1S/C13H23N5O/c1-3-4-10-12(17-14)15-8-16-13(10)18-6-5-11(19)9(2)7-18/h8-9,11,19H,3-7,14H2,1-2H3,(H,15,16,17)
InChIKeyCNIPSAMHGFLSLZ-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.92
Rot. Bonds4

About 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol

1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol (PubChem CID 114684050) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol
PubChem CID114684050
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol
SMILESCCCc1c(NN)ncnc1N1CCC(O)C(C)C1
InChIInChI=1S/C13H23N5O/c1-3-4-10-12(17-14)15-8-16-13(10)18-6-5-11(19)9(2)7-18/h8-9,11,19H,3-7,14H2,1-2H3,(H,15,16,17)
InChIKeyCNIPSAMHGFLSLZ-UHFFFAOYSA-N
XLogP0.92
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.92
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 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol (CID 114684050) is 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol is CCCc1c(NN)ncnc1N1CCC(O)C(C)C1.
What is the InChIKey of 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol?
The InChIKey is CNIPSAMHGFLSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-4-10-12(17-14)15-8-16-13(10)18-6-5-11(19)9(2)7-18/h8-9,11,19H,3-7,14H2,1-2H3,(H,15,16,17).
What are the key properties of 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol?
1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol has a molecular weight of 265.36 g/mol, XLogP of 0.92, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114684050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).