(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine

C12H17N3O2S — CID 11999030

IUPAC(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine
SMILESCC1CCc2nc(N3CCOCC3)sc2/C1=N\O
InChIInChI=1S/C12H17N3O2S/c1-8-2-3-9-11(10(8)14-16)18-12(13-9)15-4-6-17-7-5-15/h8,16H,2-7H2,1H3/b14-10-
InChIKeyMATDEKQHYFEYPU-UVTDQMKNSA-N
MW267.35 g/mol
LogP1.74
Rot. Bonds1

About (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine

(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine (PubChem CID 11999030) has the molecular formula C12H17N3O2S and a molecular weight of 267.35 g/mol. Its IUPAC name is (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine
PubChem CID11999030
Molecular FormulaC12H17N3O2S
Molecular Weight267.35 g/mol
Exact Mass267.10
IUPAC Name(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine
SMILESCC1CCc2nc(N3CCOCC3)sc2/C1=N\O
InChIInChI=1S/C12H17N3O2S/c1-8-2-3-9-11(10(8)14-16)18-12(13-9)15-4-6-17-7-5-15/h8,16H,2-7H2,1H3/b14-10-
InChIKeyMATDEKQHYFEYPU-UVTDQMKNSA-N
XLogP1.74
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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'}

Analyze (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine (CID 11999030) is (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine is CC1CCc2nc(N3CCOCC3)sc2/C1=N\O.
What is the InChIKey of (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine?
The InChIKey is MATDEKQHYFEYPU-UVTDQMKNSA-N. The full InChI is InChI=1S/C12H17N3O2S/c1-8-2-3-9-11(10(8)14-16)18-12(13-9)15-4-6-17-7-5-15/h8,16H,2-7H2,1H3/b14-10-.
What are the key properties of (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine?
(NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine has a molecular weight of 267.35 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(6-methyl-2-morpholin-4-yl-5,6-dihydro-4H-1,3-benzothiazol-7-ylidene)hydroxylamine is sourced from PubChem (CID 11999030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).