2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide

C11H12ClN5OS — CID 62241867

IUPAC2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide
SMILESCc1nc(NC(=O)c2cc(Cl)nc(NN)c2)sc1C
InChIInChI=1S/C11H12ClN5OS/c1-5-6(2)19-11(14-5)16-10(18)7-3-8(12)15-9(4-7)17-13/h3-4H,13H2,1-2H3,(H,15,17)(H,14,16,18)
InChIKeyTZPWVDJEKBOKQH-UHFFFAOYSA-N
MW297.77 g/mol
LogP2.35
Rot. Bonds3

About 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide

2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide (PubChem CID 62241867) has the molecular formula C11H12ClN5OS and a molecular weight of 297.77 g/mol. Its IUPAC name is 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide
PubChem CID62241867
Molecular FormulaC11H12ClN5OS
Molecular Weight297.77 g/mol
Exact Mass297.05
IUPAC Name2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide
SMILESCc1nc(NC(=O)c2cc(Cl)nc(NN)c2)sc1C
InChIInChI=1S/C11H12ClN5OS/c1-5-6(2)19-11(14-5)16-10(18)7-3-8(12)15-9(4-7)17-13/h3-4H,13H2,1-2H3,(H,15,17)(H,14,16,18)
InChIKeyTZPWVDJEKBOKQH-UHFFFAOYSA-N
XLogP2.35
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.77
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-hydrazinyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyridine-4-carboxamide
CID 106262288
2-chloro-6-hydrazinyl-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62248114
2,6-dichloro-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 60786100
6-amino-5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62185172
2-chloro-N-(2,3-dimethylphenyl)-6-hydrazinylpyridine-4-carboxamide
CID 62241615
2-[(2,6-dichloropyridine-4-carbonyl)amino]-N,N,4-trimethyl-1,3-thiazole-5-carboxamide
CID 142147683
2-chloro-6-hydrazinyl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914433
N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-methylthiophene-3-carboxamide
CID 17191166
2-chloro-N-(4-fluorophenyl)-6-hydrazinylpyridine-4-carboxamide
CID 55052514
2-chloro-N-[4-(dimethylamino)phenyl]-6-hydrazinylpyridine-4-carboxamide
CID 62236339
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 83170176
2-chloro-6-hydrazinyl-N-(1-methylpyrazol-4-yl)pyridine-4-carboxamide
CID 62242493

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide (CID 62241867) is 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide is Cc1nc(NC(=O)c2cc(Cl)nc(NN)c2)sc1C.
What is the InChIKey of 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide?
The InChIKey is TZPWVDJEKBOKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5OS/c1-5-6(2)19-11(14-5)16-10(18)7-3-8(12)15-9(4-7)17-13/h3-4H,13H2,1-2H3,(H,15,17)(H,14,16,18).
What are the key properties of 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide?
2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide has a molecular weight of 297.77 g/mol, XLogP of 2.35, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 62241867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).