N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide

C18H20ClN7O — CID 143620247

IUPACN-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide
SMILESCC(C)(/C(=N/N)NN)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C18H20ClN7O/c1-18(2,17(24-20)25-21)12-5-3-11(4-6-12)16(27)23-14-10-26-9-13(19)7-8-15(26)22-14/h3-10H,20-21H2,1-2H3,(H,23,27)(H,24,25)
InChIKeyRTFAUOSCHDLVKA-UHFFFAOYSA-N
MW385.86 g/mol
LogP2.25
Rot. Bonds4

About N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide

N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide (PubChem CID 143620247) has the molecular formula C18H20ClN7O and a molecular weight of 385.86 g/mol. Its IUPAC name is N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide.

Molecular Properties

Compound NameN-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide
PubChem CID143620247
Molecular FormulaC18H20ClN7O
Molecular Weight385.86 g/mol
Exact Mass385.14
IUPAC NameN-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide
SMILESCC(C)(/C(=N/N)NN)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C18H20ClN7O/c1-18(2,17(24-20)25-21)12-5-3-11(4-6-12)16(27)23-14-10-26-9-13(19)7-8-15(26)22-14/h3-10H,20-21H2,1-2H3,(H,23,27)(H,24,25)
InChIKeyRTFAUOSCHDLVKA-UHFFFAOYSA-N
XLogP2.25
TPSA122.83 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.86
LogP ≤ 52.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[2-methyl-1-(propanoylamino)propan-2-yl]benzamide
CID 59175341
4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
CID 68661308
methyl 2-[4-[(6-iodoimidazo[1,2-a]pyridin-2-yl)carbamoyl]phenyl]-2-methylpropanoate
CID 59175639
2-methyl-2-[4-[(6-thiophen-3-ylimidazo[1,2-a]pyridin-2-yl)carbamoyl]phenyl]propanoic acid
CID 53321232
4-tert-butyl-N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)benzamide
CID 59175581
4-tert-butyl-N-(6-imidazol-1-ylimidazo[1,2-a]pyridin-2-yl)benzamide;methanesulfonic acid
CID 86638590
N-(6-iodoimidazo[1,2-a]pyridin-2-yl)-4-methylsulfonylbenzamide
CID 68661287
4-(4-cyano-2-methylbutan-2-yl)-N-(6-iodoimidazo[1,2-a]pyridin-2-yl)benzamide
CID 59175307
N-(6-imidazol-1-ylimidazo[1,2-a]pyridin-2-yl)-4-[1-(methanesulfonamido)-2-methylpropan-2-yl]benzamide
CID 59175320
4-bromo-N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 42737491
4-tert-butyl-N-(5-methylimidazo[1,2-a]pyridin-2-yl)benzamide;hydrochloride
CID 68661288
methyl 4-[(6-chloroimidazo[1,2-a]pyridine-2-carbonyl)amino]benzoate
CID 42536775

Frequently Asked Questions

What is the IUPAC name of N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide?
The IUPAC name of N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide (CID 143620247) is N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide.
What is the SMILES notation for N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide?
The canonical SMILES for N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide is CC(C)(/C(=N/N)NN)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1.
What is the InChIKey of N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide?
The InChIKey is RTFAUOSCHDLVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN7O/c1-18(2,17(24-20)25-21)12-5-3-11(4-6-12)16(27)23-14-10-26-9-13(19)7-8-15(26)22-14/h3-10H,20-21H2,1-2H3,(H,23,27)(H,24,25).
What are the key properties of N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide?
N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide has a molecular weight of 385.86 g/mol, XLogP of 2.25, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroimidazo[1,2-a]pyridin-2-yl)-4-[(1Z)-1-hydrazinyl-1-hydrazinylidene-2-methylpropan-2-yl]benzamide is sourced from PubChem (CID 143620247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).