N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide

C13H15BrN4O2 — CID 154789281

IUPACN'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide
SMILESCC(C)C(=O)NNC(=O)Cc1nc2ccccn2c1Br
InChIInChI=1S/C13H15BrN4O2/c1-8(2)13(20)17-16-11(19)7-9-12(14)18-6-4-3-5-10(18)15-9/h3-6,8H,7H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyFQNXZOKWZCFYHM-UHFFFAOYSA-N
MW339.19 g/mol
LogP1.44
Rot. Bonds3

About N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide

N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide (PubChem CID 154789281) has the molecular formula C13H15BrN4O2 and a molecular weight of 339.19 g/mol. Its IUPAC name is N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide.

Molecular Properties

Compound NameN'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide
PubChem CID154789281
Molecular FormulaC13H15BrN4O2
Molecular Weight339.19 g/mol
Exact Mass338.04
IUPAC NameN'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide
SMILESCC(C)C(=O)NNC(=O)Cc1nc2ccccn2c1Br
InChIInChI=1S/C13H15BrN4O2/c1-8(2)13(20)17-16-11(19)7-9-12(14)18-6-4-3-5-10(18)15-9/h3-6,8H,7H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyFQNXZOKWZCFYHM-UHFFFAOYSA-N
XLogP1.44
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.19
LogP ≤ 51.44
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-(3-bromoimidazo[1,2-a]pyridin-2-yl)propanoic acid
CID 83693870
3-bromo-2-(2-hydroxyethyl)pyrido[1,2-a]pyrimidin-4-one
CID 67509636
methyl 3-bromoimidazo[1,2-a]pyridine-2-carboxylate;dihydrobromide
CID 75531045
3-bromo-N-(1-phenylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 140676211
3-bromoimidazo[1,2-a]pyridine-2-carboxamide
CID 154211458
3-bromo-2-(hydroxymethyl)pyrido[1,2-a]pyrimidin-4-one;(3-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl acetate
CID 161408506
[amino-[(3-bromoimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]methylidene]azanium bromide
CID 45129671
(3-iodoimidazo[1,2-a]pyridin-2-yl)methyl propanoate
CID 141396656
3-bromo-2-ethylimidazo[1,2-a]pyridine;2-ethylimidazo[1,2-a]pyridine
CID 159450021
1-(2-ethylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 76849304
3-[2-(4-bromophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(4-phenylbutan-2-yl)propanamide
CID 53118637
3-bromo-2-[(6,6-dimethyl-3-azabicyclo[3.1.0]hexan-3-yl)methyl]imidazo[1,2-a]pyridine
CID 166210907

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide?
The IUPAC name of N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide (CID 154789281) is N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide.
What is the SMILES notation for N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide?
The canonical SMILES for N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide is CC(C)C(=O)NNC(=O)Cc1nc2ccccn2c1Br.
What is the InChIKey of N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide?
The InChIKey is FQNXZOKWZCFYHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN4O2/c1-8(2)13(20)17-16-11(19)7-9-12(14)18-6-4-3-5-10(18)15-9/h3-6,8H,7H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide?
N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide has a molecular weight of 339.19 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-bromoimidazo[1,2-a]pyridin-2-yl)acetyl]-2-methylpropanehydrazide is sourced from PubChem (CID 154789281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).