N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide

C15H14N4O — CID 127025469

IUPACN'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide
SMILESO=C(NNCc1c[nH]c2ccccc12)c1ccncc1
InChIInChI=1S/C15H14N4O/c20-15(11-5-7-16-8-6-11)19-18-10-12-9-17-14-4-2-1-3-13(12)14/h1-9,17-18H,10H2,(H,19,20)
InChIKeyAFHWKTUJMRPKGG-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.00
Rot. Bonds4

About N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide

N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide (PubChem CID 127025469) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide
PubChem CID127025469
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide
SMILESO=C(NNCc1c[nH]c2ccccc12)c1ccncc1
InChIInChI=1S/C15H14N4O/c20-15(11-5-7-16-8-6-11)19-18-10-12-9-17-14-4-2-1-3-13(12)14/h1-9,17-18H,10H2,(H,19,20)
InChIKeyAFHWKTUJMRPKGG-UHFFFAOYSA-N
XLogP2.00
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide?
The IUPAC name of N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide (CID 127025469) is N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide.
What is the SMILES notation for N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide?
The canonical SMILES for N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide is O=C(NNCc1c[nH]c2ccccc12)c1ccncc1.
What is the InChIKey of N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide?
The InChIKey is AFHWKTUJMRPKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c20-15(11-5-7-16-8-6-11)19-18-10-12-9-17-14-4-2-1-3-13(12)14/h1-9,17-18H,10H2,(H,19,20).
What are the key properties of N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide?
N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide has a molecular weight of 266.30 g/mol, XLogP of 2.00, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1H-indol-3-ylmethyl)pyridine-4-carbohydrazide is sourced from PubChem (CID 127025469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).