2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide

C15H18N4O — CID 62237813

IUPAC2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide
SMILESNNc1ncccc1C(=O)NCCCc1ccccc1
InChIInChI=1S/C15H18N4O/c16-19-14-13(9-5-10-17-14)15(20)18-11-4-8-12-6-2-1-3-7-12/h1-3,5-7,9-10H,4,8,11,16H2,(H,17,19)(H,18,20)
InChIKeyGGKBWMGICNYIIN-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.73
Rot. Bonds6

About 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide

2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide (PubChem CID 62237813) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide
PubChem CID62237813
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide
SMILESNNc1ncccc1C(=O)NCCCc1ccccc1
InChIInChI=1S/C15H18N4O/c16-19-14-13(9-5-10-17-14)15(20)18-11-4-8-12-6-2-1-3-7-12/h1-3,5-7,9-10H,4,8,11,16H2,(H,17,19)(H,18,20)
InChIKeyGGKBWMGICNYIIN-UHFFFAOYSA-N
XLogP1.73
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The IUPAC name of 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide (CID 62237813) is 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide is NNc1ncccc1C(=O)NCCCc1ccccc1.
What is the InChIKey of 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
The InChIKey is GGKBWMGICNYIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c16-19-14-13(9-5-10-17-14)15(20)18-11-4-8-12-6-2-1-3-7-12/h1-3,5-7,9-10H,4,8,11,16H2,(H,17,19)(H,18,20).
What are the key properties of 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide?
2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.73, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(3-phenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 62237813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).