N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine

C7H11N3O — CID 82595166

IUPACN-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine
SMILESCc1nccnc1CN(C)O
InChIInChI=1S/C7H11N3O/c1-6-7(5-10(2)11)9-4-3-8-6/h3-4,11H,5H2,1-2H3
InChIKeyYWMNVUFODIKAAN-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.61
Rot. Bonds2

About N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine

N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine (PubChem CID 82595166) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine
PubChem CID82595166
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC NameN-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine
SMILESCc1nccnc1CN(C)O
InChIInChI=1S/C7H11N3O/c1-6-7(5-10(2)11)9-4-3-8-6/h3-4,11H,5H2,1-2H3
InChIKeyYWMNVUFODIKAAN-UHFFFAOYSA-N
XLogP0.61
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.61
H-Bond Donors ≤ 51
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-methylpyrazin-2-yl)ethanimidamide
CID 83676288
1-(3-methylpyrazin-2-yl)pentan-2-one
CID 83063963
(2S,3S)-4-(3-methylpyrazin-2-yl)butane-1,2,3-triol
CID 162852982
3-(3-methylpyrazin-2-yl)propan-1-amine
CID 82417256
2-(2-bromo-3-methylbutyl)-3-methylpyrazine
CID 83063663
2-methyl-3-[2-(5-methylpyridazin-4-yl)ethyl]pyrazine
CID 146588489
4-[[[(3-hydroxy-2-methyl-4-pyridinyl)methyl-methylamino]methyl-methylamino]methyl]-2-methylpyridin-3-ol
CID 54096009
N,N-dimethyl-1-(3-methyl-2-pyridinyl)methanamine
CID 20666322
2-methyl-2-[methyl-[(2-methyl-3-pyridinyl)methyl]amino]propan-1-ol
CID 115882420
N-benzyl-N,3-dimethylpyrazin-2-amine;ethane
CID 145242073
N-[(2,5-dimethoxypyrimidin-4-yl)methyl]-N-methylhydroxylamine
CID 82658243
N-methyl-1-(3-methylpyrazin-2-yl)pentan-2-amine
CID 83064291

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine?
The IUPAC name of N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine (CID 82595166) is N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine.
What is the SMILES notation for N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine?
The canonical SMILES for N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine is Cc1nccnc1CN(C)O.
What is the InChIKey of N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine?
The InChIKey is YWMNVUFODIKAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-6-7(5-10(2)11)9-4-3-8-6/h3-4,11H,5H2,1-2H3.
What are the key properties of N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine?
N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine has a molecular weight of 153.19 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(3-methylpyrazin-2-yl)methyl]hydroxylamine is sourced from PubChem (CID 82595166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).