N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide

C15H12N4O — CID 53431953

IUPACN-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide
SMILESNN(C=C1C=Nc2ccccc21)C(=O)c1ccncc1
InChIInChI=1S/C15H12N4O/c16-19(15(20)11-5-7-17-8-6-11)10-12-9-18-14-4-2-1-3-13(12)14/h1-10H,16H2
InChIKeyKNDGJZCWELTXBQ-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.15
Rot. Bonds2

About N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide

N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide (PubChem CID 53431953) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide.

Molecular Properties

Compound NameN-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide
PubChem CID53431953
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC NameN-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide
SMILESNN(C=C1C=Nc2ccccc21)C(=O)c1ccncc1
InChIInChI=1S/C15H12N4O/c16-19(15(20)11-5-7-17-8-6-11)10-12-9-18-14-4-2-1-3-13(12)14/h1-10H,16H2
InChIKeyKNDGJZCWELTXBQ-UHFFFAOYSA-N
XLogP2.15
TPSA71.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.15
H-Bond Donors ≤ 51
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 N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide?
The IUPAC name of N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide (CID 53431953) is N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide.
What is the SMILES notation for N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide?
The canonical SMILES for N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide is NN(C=C1C=Nc2ccccc21)C(=O)c1ccncc1.
What is the InChIKey of N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide?
The InChIKey is KNDGJZCWELTXBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c16-19(15(20)11-5-7-17-8-6-11)10-12-9-18-14-4-2-1-3-13(12)14/h1-10H,16H2.
What are the key properties of N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide?
N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide has a molecular weight of 264.29 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide is sourced from PubChem (CID 53431953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).