5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide

C11H13N5OS — CID 104642763

IUPAC5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide
SMILESCc1ncsc1CNC(=O)c1ccc(NN)cn1
InChIInChI=1S/C11H13N5OS/c1-7-10(18-6-15-7)5-14-11(17)9-3-2-8(16-12)4-13-9/h2-4,6,16H,5,12H2,1H3,(H,14,17)
InChIKeySTGVQBBTAQQLGH-UHFFFAOYSA-N
MW263.33 g/mol
LogP1.06
Rot. Bonds4

About 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide

5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide (PubChem CID 104642763) has the molecular formula C11H13N5OS and a molecular weight of 263.33 g/mol. Its IUPAC name is 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide
PubChem CID104642763
Molecular FormulaC11H13N5OS
Molecular Weight263.33 g/mol
Exact Mass263.08
IUPAC Name5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide
SMILESCc1ncsc1CNC(=O)c1ccc(NN)cn1
InChIInChI=1S/C11H13N5OS/c1-7-10(18-6-15-7)5-14-11(17)9-3-2-8(16-12)4-13-9/h2-4,6,16H,5,12H2,1H3,(H,14,17)
InChIKeySTGVQBBTAQQLGH-UHFFFAOYSA-N
XLogP1.06
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.33
LogP ≤ 51.06
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 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide (CID 104642763) is 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide is Cc1ncsc1CNC(=O)c1ccc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide?
The InChIKey is STGVQBBTAQQLGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5OS/c1-7-10(18-6-15-7)5-14-11(17)9-3-2-8(16-12)4-13-9/h2-4,6,16H,5,12H2,1H3,(H,14,17).
What are the key properties of 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide?
5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide has a molecular weight of 263.33 g/mol, XLogP of 1.06, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 104642763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).