4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide

C12H13N5O — CID 81249230

IUPAC4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide
SMILESCc1cnccc1NC(=O)c1cnccc1NN
InChIInChI=1S/C12H13N5O/c1-8-6-14-4-2-10(8)16-12(18)9-7-15-5-3-11(9)17-13/h2-7H,13H2,1H3,(H,15,17)(H,14,16,18)
InChIKeyUORDKPDCNBUWGT-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.32
Rot. Bonds3

About 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide

4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide (PubChem CID 81249230) has the molecular formula C12H13N5O and a molecular weight of 243.27 g/mol. Its IUPAC name is 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide
PubChem CID81249230
Molecular FormulaC12H13N5O
Molecular Weight243.27 g/mol
Exact Mass243.11
IUPAC Name4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide
SMILESCc1cnccc1NC(=O)c1cnccc1NN
InChIInChI=1S/C12H13N5O/c1-8-6-14-4-2-10(8)16-12(18)9-7-15-5-3-11(9)17-13/h2-7H,13H2,1H3,(H,15,17)(H,14,16,18)
InChIKeyUORDKPDCNBUWGT-UHFFFAOYSA-N
XLogP1.32
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.32
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 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide (CID 81249230) is 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide is Cc1cnccc1NC(=O)c1cnccc1NN.
What is the InChIKey of 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide?
The InChIKey is UORDKPDCNBUWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O/c1-8-6-14-4-2-10(8)16-12(18)9-7-15-5-3-11(9)17-13/h2-7H,13H2,1H3,(H,15,17)(H,14,16,18).
What are the key properties of 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide?
4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 1.32, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(3-methyl-4-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 81249230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).