6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide

C13H20N4O2 — CID 106909183

IUPAC6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESCOCCN(Cc1cccc(C(=O)NN)n1)C1CC1
InChIInChI=1S/C13H20N4O2/c1-19-8-7-17(11-5-6-11)9-10-3-2-4-12(15-10)13(18)16-14/h2-4,11H,5-9,14H2,1H3,(H,16,18)
InChIKeyCFJIFNBCYXPKIS-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.30
Rot. Bonds7

About 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide

6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide (PubChem CID 106909183) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide
PubChem CID106909183
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide
SMILESCOCCN(Cc1cccc(C(=O)NN)n1)C1CC1
InChIInChI=1S/C13H20N4O2/c1-19-8-7-17(11-5-6-11)9-10-3-2-4-12(15-10)13(18)16-14/h2-4,11H,5-9,14H2,1H3,(H,16,18)
InChIKeyCFJIFNBCYXPKIS-UHFFFAOYSA-N
XLogP0.30
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.30
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-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide (CID 106909183) is 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide is COCCN(Cc1cccc(C(=O)NN)n1)C1CC1.
What is the InChIKey of 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide?
The InChIKey is CFJIFNBCYXPKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-19-8-7-17(11-5-6-11)9-10-3-2-4-12(15-10)13(18)16-14/h2-4,11H,5-9,14H2,1H3,(H,16,18).
What are the key properties of 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide?
6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide has a molecular weight of 264.33 g/mol, XLogP of 0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[cyclopropyl(2-methoxyethyl)amino]methyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 106909183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).