N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide

C8H12N2O3 — CID 174921681

IUPACN,N-dimethylpyridine-3-carboxamide;hydrogen peroxide
SMILESCN(C)C(=O)c1cccnc1.OO
InChIInChI=1S/C8H10N2O.H2O2/c1-10(2)8(11)7-4-3-5-9-6-7;1-2/h3-6H,1-2H3;1-2H
InChIKeySUOCXEGKFBRVAI-UHFFFAOYSA-N
MW184.20 g/mol
LogP0.80
Rot. Bonds1

About N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide

N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide (PubChem CID 174921681) has the molecular formula C8H12N2O3 and a molecular weight of 184.20 g/mol. Its IUPAC name is N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide.

Molecular Properties

Compound NameN,N-dimethylpyridine-3-carboxamide;hydrogen peroxide
PubChem CID174921681
Molecular FormulaC8H12N2O3
Molecular Weight184.20 g/mol
Exact Mass184.08
IUPAC NameN,N-dimethylpyridine-3-carboxamide;hydrogen peroxide
SMILESCN(C)C(=O)c1cccnc1.OO
InChIInChI=1S/C8H10N2O.H2O2/c1-10(2)8(11)7-4-3-5-9-6-7;1-2/h3-6H,1-2H3;1-2H
InChIKeySUOCXEGKFBRVAI-UHFFFAOYSA-N
XLogP0.80
TPSA73.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethylpyridine-3-carboxamide;ethane
CID 142562125
N-methyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756365
N-(chloromethyl)-N-methylpyridine-3-carboxamide
CID 141227221
N-amino-N-hydroxypyridine-3-carboxamide
CID 54392890
N-[2,2-dimethyl-3-[methyl(pyridine-3-carbonyl)amino]propyl]-N-methylpyridine-3-carboxamide
CID 166390474
CID 157283677
CID 157283677
1-phenyl-2-pyridin-3-ylethane-1,2-dione
CID 10987556
nickel;pyridine-3-carboxylic acid
CID 174049937
1-(dimethylamino)ethanol;pyridine-3-carboxylic acid
CID 23620885
N-methyl-N-(trifluoromethylsulfonyl)pyridine-3-carboxamide
CID 71032143
N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-carboxamide
CID 79290970
(111C)methyl pyridine-3-carboxylate
CID 11309537

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide?
The IUPAC name of N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide (CID 174921681) is N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide.
What is the SMILES notation for N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide?
The canonical SMILES for N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide is CN(C)C(=O)c1cccnc1.OO.
What is the InChIKey of N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide?
The InChIKey is SUOCXEGKFBRVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O.H2O2/c1-10(2)8(11)7-4-3-5-9-6-7;1-2/h3-6H,1-2H3;1-2H.
What are the key properties of N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide?
N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide has a molecular weight of 184.20 g/mol, XLogP of 0.80, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpyridine-3-carboxamide;hydrogen peroxide is sourced from PubChem (CID 174921681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).