N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine

C6H10N2O2S — CID 82598709

IUPACN-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine
SMILESCOc1ncc(CN(C)O)s1
InChIInChI=1S/C6H10N2O2S/c1-8(9)4-5-3-7-6(10-2)11-5/h3,9H,4H2,1-2H3
InChIKeyXRJFRWCMGOXFIU-UHFFFAOYSA-N
MW174.23 g/mol
LogP0.97
Rot. Bonds3

About N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine

N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine (PubChem CID 82598709) has the molecular formula C6H10N2O2S and a molecular weight of 174.23 g/mol. Its IUPAC name is N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine.

Molecular Properties

Compound NameN-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine
PubChem CID82598709
Molecular FormulaC6H10N2O2S
Molecular Weight174.23 g/mol
Exact Mass174.05
IUPAC NameN-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine
SMILESCOc1ncc(CN(C)O)s1
InChIInChI=1S/C6H10N2O2S/c1-8(9)4-5-3-7-6(10-2)11-5/h3,9H,4H2,1-2H3
InChIKeyXRJFRWCMGOXFIU-UHFFFAOYSA-N
XLogP0.97
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxy-1,3-thiazol-5-yl)ethanol
CID 83674256
5-(2-chloroethyl)-2-methoxy-1,3-thiazole
CID 130590548
5-(3-bromopropyl)-2-methoxy-1,3-thiazole
CID 130593249
5-(cyclopent-3-en-1-ylmethyl)-2-methoxy-1,3-thiazole
CID 164652619
2-methoxy-1,3-thiazol-5-ol
CID 130658802
2-methoxy-5-methyl-1,3-thiazole
CID 12743061
methyl 4-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]butanoate
CID 62045674
ethyl 3-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]propanoate
CID 61372216
5-[[2-methoxyethyl(methyl)amino]methyl]-1,3-thiazol-2-amine
CID 79771856
N-[(2,5-dimethoxypyrimidin-4-yl)methyl]-N-methylhydroxylamine
CID 82658243
5-[(2-methoxy-N-methylanilino)methyl]-1,3-thiazol-2-amine
CID 79772599
methyl 5-ethyl-1,3-thiazole-2-carboximidate
CID 130979726

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine?
The IUPAC name of N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine (CID 82598709) is N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine.
What is the SMILES notation for N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine?
The canonical SMILES for N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine is COc1ncc(CN(C)O)s1.
What is the InChIKey of N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine?
The InChIKey is XRJFRWCMGOXFIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-8(9)4-5-3-7-6(10-2)11-5/h3,9H,4H2,1-2H3.
What are the key properties of N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine?
N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine has a molecular weight of 174.23 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-1,3-thiazol-5-yl)methyl]-N-methylhydroxylamine is sourced from PubChem (CID 82598709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).