4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide

C13H22N4O3 — CID 114098389

IUPAC4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide
SMILESCOCCOCCCNC(=O)c1cnc(C)cc1NN
InChIInChI=1S/C13H22N4O3/c1-10-8-12(17-14)11(9-16-10)13(18)15-4-3-5-20-7-6-19-2/h8-9H,3-7,14H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyLNXIZOMZHLWJQP-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.46
Rot. Bonds9

About 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide

4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide (PubChem CID 114098389) has the molecular formula C13H22N4O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide
PubChem CID114098389
Molecular FormulaC13H22N4O3
Molecular Weight282.34 g/mol
Exact Mass282.17
IUPAC Name4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide
SMILESCOCCOCCCNC(=O)c1cnc(C)cc1NN
InChIInChI=1S/C13H22N4O3/c1-10-8-12(17-14)11(9-16-10)13(18)15-4-3-5-20-7-6-19-2/h8-9H,3-7,14H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyLNXIZOMZHLWJQP-UHFFFAOYSA-N
XLogP0.46
TPSA98.50 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.46
H-Bond Donors ≤ 53
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 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide (CID 114098389) is 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide is COCCOCCCNC(=O)c1cnc(C)cc1NN.
What is the InChIKey of 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide?
The InChIKey is LNXIZOMZHLWJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O3/c1-10-8-12(17-14)11(9-16-10)13(18)15-4-3-5-20-7-6-19-2/h8-9H,3-7,14H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide?
4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 0.46, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[3-(2-methoxyethoxy)propyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 114098389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).