3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide

C12H19N5O — CID 105071671

IUPAC3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
SMILESCN1CCCC(NC(=O)c2ccncc2NN)C1
InChIInChI=1S/C12H19N5O/c1-17-6-2-3-9(8-17)15-12(18)10-4-5-14-7-11(10)16-13/h4-5,7,9,16H,2-3,6,8,13H2,1H3,(H,15,18)
InChIKeyONLUFBGLQOMOEU-UHFFFAOYSA-N
MW249.32 g/mol
LogP0.19
Rot. Bonds3

About 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide

3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide (PubChem CID 105071671) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
PubChem CID105071671
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
SMILESCN1CCCC(NC(=O)c2ccncc2NN)C1
InChIInChI=1S/C12H19N5O/c1-17-6-2-3-9(8-17)15-12(18)10-4-5-14-7-11(10)16-13/h4-5,7,9,16H,2-3,6,8,13H2,1H3,(H,15,18)
InChIKeyONLUFBGLQOMOEU-UHFFFAOYSA-N
XLogP0.19
TPSA83.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 50.19
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 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide (CID 105071671) is 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide is CN1CCCC(NC(=O)c2ccncc2NN)C1.
What is the InChIKey of 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The InChIKey is ONLUFBGLQOMOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-17-6-2-3-9(8-17)15-12(18)10-4-5-14-7-11(10)16-13/h4-5,7,9,16H,2-3,6,8,13H2,1H3,(H,15,18).
What are the key properties of 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide has a molecular weight of 249.32 g/mol, XLogP of 0.19, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 105071671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).