N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide

C12H14N4O2 — CID 2814534

IUPACN'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
SMILESCC(=O)NNC(=O)c1c(C)nc2cc(C)ccn12
InChIInChI=1S/C12H14N4O2/c1-7-4-5-16-10(6-7)13-8(2)11(16)12(18)15-14-9(3)17/h4-6H,1-3H3,(H,14,17)(H,15,18)
InChIKeyXGFMBEGNIQYDSL-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.73
Rot. Bonds1

About N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide

N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide (PubChem CID 2814534) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
PubChem CID2814534
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC NameN'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide
SMILESCC(=O)NNC(=O)c1c(C)nc2cc(C)ccn12
InChIInChI=1S/C12H14N4O2/c1-7-4-5-16-10(6-7)13-8(2)11(16)12(18)15-14-9(3)17/h4-6H,1-3H3,(H,14,17)(H,15,18)
InChIKeyXGFMBEGNIQYDSL-UHFFFAOYSA-N
XLogP0.73
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-2-methylpropanoic acid
CID 39186456
N-[(4-chlorophenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 53248894
2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-methylpentanoic acid
CID 82032865
N-[(1R,5R,6S,7R)-7-acetamido-2-oxabicyclo[3.2.0]heptan-6-yl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 91779867
2,7-dimethyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 134140165
2,7-dimethyl-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 137001767
2,7-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121274552
N-[(Z)-(4-tert-butylphenyl)methylideneamino]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 126009877
2-[(Z)-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)hydrazinylidene]methyl]benzoic acid
CID 126022665
N-[3-(furan-2-yl)propyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 56759259
7-chloro-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
CID 82530149
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 119062037

Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide?
The IUPAC name of N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide (CID 2814534) is N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide?
The canonical SMILES for N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide is CC(=O)NNC(=O)c1c(C)nc2cc(C)ccn12.
What is the InChIKey of N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide?
The InChIKey is XGFMBEGNIQYDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-7-4-5-16-10(6-7)13-8(2)11(16)12(18)15-14-9(3)17/h4-6H,1-3H3,(H,14,17)(H,15,18).
What are the key properties of N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide?
N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide has a molecular weight of 246.27 g/mol, XLogP of 0.73, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2,7-dimethylimidazo[1,2-a]pyridine-3-carbohydrazide is sourced from PubChem (CID 2814534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).