(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone

C11H16N4O2 — CID 62249880

IUPAC(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone
SMILESNNc1ncccc1C(=O)N1CCCC(O)C1
InChIInChI=1S/C11H16N4O2/c12-14-10-9(4-1-5-13-10)11(17)15-6-2-3-8(16)7-15/h1,4-5,8,16H,2-3,6-7,12H2,(H,13,14)
InChIKeyIIAAZTUMHGBMHZ-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.04
Rot. Bonds2

About (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone

(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone (PubChem CID 62249880) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone
PubChem CID62249880
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone
SMILESNNc1ncccc1C(=O)N1CCCC(O)C1
InChIInChI=1S/C11H16N4O2/c12-14-10-9(4-1-5-13-10)11(17)15-6-2-3-8(16)7-15/h1,4-5,8,16H,2-3,6-7,12H2,(H,13,14)
InChIKeyIIAAZTUMHGBMHZ-UHFFFAOYSA-N
XLogP-0.04
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone?
The IUPAC name of (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone (CID 62249880) is (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone is NNc1ncccc1C(=O)N1CCCC(O)C1.
What is the InChIKey of (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone?
The InChIKey is IIAAZTUMHGBMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c12-14-10-9(4-1-5-13-10)11(17)15-6-2-3-8(16)7-15/h1,4-5,8,16H,2-3,6-7,12H2,(H,13,14).
What are the key properties of (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone?
(2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone has a molecular weight of 236.27 g/mol, XLogP of -0.04, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydrazinyl-3-pyridinyl)-(3-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 62249880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).