2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide

C13H16N6O — CID 113379230

IUPAC2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1cnc(CNC(=O)c2cc(C)nc(NN)c2)cn1
InChIInChI=1S/C13H16N6O/c1-8-3-10(4-12(18-8)19-14)13(20)17-7-11-6-15-9(2)5-16-11/h3-6H,7,14H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyMMBSZCSBCUMBOM-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.70
Rot. Bonds4

About 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide

2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide (PubChem CID 113379230) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide
PubChem CID113379230
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC Name2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1cnc(CNC(=O)c2cc(C)nc(NN)c2)cn1
InChIInChI=1S/C13H16N6O/c1-8-3-10(4-12(18-8)19-14)13(20)17-7-11-6-15-9(2)5-16-11/h3-6H,7,14H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyMMBSZCSBCUMBOM-UHFFFAOYSA-N
XLogP0.70
TPSA105.82 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'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-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide (CID 113379230) is 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide is Cc1cnc(CNC(=O)c2cc(C)nc(NN)c2)cn1.
What is the InChIKey of 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide?
The InChIKey is MMBSZCSBCUMBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c1-8-3-10(4-12(18-8)19-14)13(20)17-7-11-6-15-9(2)5-16-11/h3-6H,7,14H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide?
2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 0.70, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-6-methyl-N-[(5-methylpyrazin-2-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 113379230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).