N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine

C6H8N2OS — CID 137186649

IUPACN-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine
SMILESCC(=NO)c1nc(C)cs1
InChIInChI=1S/C6H8N2OS/c1-4-3-10-6(7-4)5(2)8-9/h3,9H,1-2H3
InChIKeyKUXYFHPJHDGKAA-UHFFFAOYSA-N
MW156.21 g/mol
LogP1.65
Rot. Bonds1

About N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine

N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine (PubChem CID 137186649) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine.

Molecular Properties

Compound NameN-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine
PubChem CID137186649
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC NameN-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine
SMILESCC(=NO)c1nc(C)cs1
InChIInChI=1S/C6H8N2OS/c1-4-3-10-6(7-4)5(2)8-9/h3,9H,1-2H3
InChIKeyKUXYFHPJHDGKAA-UHFFFAOYSA-N
XLogP1.65
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydroxyimino-2-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 135436049
2-hydroxyimino-2-(4-methyl-1,3-thiazol-2-yl)acetamide;silver
CID 135519768
4-methyl-N-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazole-2-carboxamide
CID 110696245
2,2-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)propan-1-one
CID 83388796
4-methyl-N-propyl-1,3-thiazole-2-carboxamide
CID 110696075
1-(4-methyl-1,3-thiazol-2-yl)butan-1-one
CID 20560347
2-bromo-1-(4-methyl-1,3-thiazol-2-yl)ethanone;hydrochloride
CID 121225631
2-bromo-1-(4-methyl-1,3-thiazol-2-yl)ethanone;hydrobromide
CID 23003355
N-[(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine
CID 136739066
(Z)-2-ethyl-3-(4-methyl-1,3-thiazol-2-yl)but-2-enoic acid
CID 165441170
(Z)-2-isocyano-N,N-dimethyl-2-(4-methyl-1,3-thiazol-2-yl)ethenamine
CID 123202912
N-amino-N'-(4-cyanophenyl)-4-methyl-1,3-thiazole-2-carboximidamide
CID 54272617

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine?
The IUPAC name of N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine (CID 137186649) is N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine.
What is the SMILES notation for N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine?
The canonical SMILES for N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine is CC(=NO)c1nc(C)cs1.
What is the InChIKey of N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine?
The InChIKey is KUXYFHPJHDGKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-4-3-10-6(7-4)5(2)8-9/h3,9H,1-2H3.
What are the key properties of N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine?
N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine has a molecular weight of 156.21 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-1,3-thiazol-2-yl)ethylidene]hydroxylamine is sourced from PubChem (CID 137186649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).