4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide

C11H23N3O2 — CID 114683804

IUPAC4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide
SMILESCC1CN(C(C)CCC(=O)NN)CCC1O
InChIInChI=1S/C11H23N3O2/c1-8-7-14(6-5-10(8)15)9(2)3-4-11(16)13-12/h8-10,15H,3-7,12H2,1-2H3,(H,13,16)
InChIKeyUHPCRHYHKWWFRZ-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.15
Rot. Bonds4

About 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide

4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide (PubChem CID 114683804) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide.

Molecular Properties

Compound Name4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide
PubChem CID114683804
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide
SMILESCC1CN(C(C)CCC(=O)NN)CCC1O
InChIInChI=1S/C11H23N3O2/c1-8-7-14(6-5-10(8)15)9(2)3-4-11(16)13-12/h8-10,15H,3-7,12H2,1-2H3,(H,13,16)
InChIKeyUHPCRHYHKWWFRZ-UHFFFAOYSA-N
XLogP-0.15
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide?
The IUPAC name of 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide (CID 114683804) is 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide.
What is the SMILES notation for 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide?
The canonical SMILES for 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide is CC1CN(C(C)CCC(=O)NN)CCC1O.
What is the InChIKey of 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide?
The InChIKey is UHPCRHYHKWWFRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-8-7-14(6-5-10(8)15)9(2)3-4-11(16)13-12/h8-10,15H,3-7,12H2,1-2H3,(H,13,16).
What are the key properties of 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide?
4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide has a molecular weight of 229.32 g/mol, XLogP of -0.15, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxy-3-methylpiperidin-1-yl)pentanehydrazide is sourced from PubChem (CID 114683804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).