3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide

C13H22N4O3 — CID 105071832

IUPAC3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide
SMILESCOCCCN(CCOC)C(=O)c1ccncc1NN
InChIInChI=1S/C13H22N4O3/c1-19-8-3-6-17(7-9-20-2)13(18)11-4-5-15-10-12(11)16-14/h4-5,10,16H,3,6-9,14H2,1-2H3
InChIKeyMUDKRXCSWZNYAY-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.49
Rot. Bonds9

About 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide

3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide (PubChem CID 105071832) has the molecular formula C13H22N4O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide
PubChem CID105071832
Molecular FormulaC13H22N4O3
Molecular Weight282.34 g/mol
Exact Mass282.17
IUPAC Name3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide
SMILESCOCCCN(CCOC)C(=O)c1ccncc1NN
InChIInChI=1S/C13H22N4O3/c1-19-8-3-6-17(7-9-20-2)13(18)11-4-5-15-10-12(11)16-14/h4-5,10,16H,3,6-9,14H2,1-2H3
InChIKeyMUDKRXCSWZNYAY-UHFFFAOYSA-N
XLogP0.49
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide?
The IUPAC name of 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide (CID 105071832) is 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide is COCCCN(CCOC)C(=O)c1ccncc1NN.
What is the InChIKey of 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide?
The InChIKey is MUDKRXCSWZNYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O3/c1-19-8-3-6-17(7-9-20-2)13(18)11-4-5-15-10-12(11)16-14/h4-5,10,16H,3,6-9,14H2,1-2H3.
What are the key properties of 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide?
3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 0.49, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridine-4-carboxamide is sourced from PubChem (CID 105071832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).