6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide

C15H19N5O — CID 106909041

IUPAC6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESCN(CCc1ccccn1)Cc1cccc(C(=O)NN)n1
InChIInChI=1S/C15H19N5O/c1-20(10-8-12-5-2-3-9-17-12)11-13-6-4-7-14(18-13)15(21)19-16/h2-7,9H,8,10-11,16H2,1H3,(H,19,21)
InChIKeyGNIHLHPUZRILMM-UHFFFAOYSA-N
MW285.35 g/mol
LogP0.75
Rot. Bonds6

About 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide

6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide (PubChem CID 106909041) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide
PubChem CID106909041
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESCN(CCc1ccccn1)Cc1cccc(C(=O)NN)n1
InChIInChI=1S/C15H19N5O/c1-20(10-8-12-5-2-3-9-17-12)11-13-6-4-7-14(18-13)15(21)19-16/h2-7,9H,8,10-11,16H2,1H3,(H,19,21)
InChIKeyGNIHLHPUZRILMM-UHFFFAOYSA-N
XLogP0.75
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide (CID 106909041) is 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide is CN(CCc1ccccn1)Cc1cccc(C(=O)NN)n1.
What is the InChIKey of 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide?
The InChIKey is GNIHLHPUZRILMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-20(10-8-12-5-2-3-9-17-12)11-13-6-4-7-14(18-13)15(21)19-16/h2-7,9H,8,10-11,16H2,1H3,(H,19,21).
What are the key properties of 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide?
6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide has a molecular weight of 285.35 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106909041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).